1D Coordination Research Articles

Symmetry Evolution Induced 2D Pt Single Atom Catalyst with High Density for Alkaline Hydrogen Oxidation.

The performance of single-atom catalysts is greatly influenced by the chemical environment surrounding the central atom. Here, a salt-assisted method is employed to transform the tetrahedral coordination structure of zeolitic imidazolate frameworks - 8 (ZIF-8)into a planar square coordination structure without altering the ligands. During the subsequent carbonization process, concurrent with the evaporation of zinc atoms, the structure of the nitrogen and carbon carriers (NC carriers) undergoes a transition from five-membered rings to six-membered rings to preserve the 2D structure. This transition results in the generation of additional defect sites on the 2D-NC substrates. Hence, the Pt single-atom catalysts with planar square coordination symmetries can be precisely prepared via electrodeposition (denoted as 2D-Pt SAC). The Pt loading of 2D-Pt SAC is 0.49 ± 0.03 µg cm-2, higher than that of 3D-Pt SAC (0.37 ± 0.04 µg cm-2). In the context of the hydrogen oxidation reaction electrocatalysis, under an overpotential of 50 mV, these single-atom catalysts with 2D coordination exhibit mass activities of 2396 A gPt -1 (32 times higher than commercial Pt/C catalyst, 2 times higher than 3D-PtNC).

Mechanochemical Synthesis and Three-Dimensional Electron Diffraction Structure Solution of a Novel Cu-Based Protocatechuate Metal-Organic Framework.

Mechanochemical synthesis is a powerful approach to obtain new materials, limiting costs, and times. However, defected and submicrometrical-sized crystal products make critical their characterization through classical single-crystal X-ray diffraction. A valid alternative is represented by three-dimensional (3D) electron diffraction, in which a transmission electron microscope is used, like a diffractometer. This work matches a green water-based mechanochemical synthesis and 3D electron diffraction to obtain and characterize a Cu-based protocatechuate metal-organic framework (PC-MOF). Its structure has been fully refined through dynamical diffraction theory, and free water molecules could be detected in the channels of the framework. Thermal characterization, focused on the dehydration profile determination, leads to the formation of a novel high-temperature 2D coordination polymer, fully solved with 3D electron diffraction data. At last, the strong activity of the PC-MOF against cationic dyes like methylene blue has been reported.

Synthesis, magnetic and fluorescence detection properties of four metal-organic frameworks based on imidazole carboxylic acid ligands

Four new metal-organic frameworks (MOFs), namely [M(HL)H2O]n (1–3) [M = Co (1), Ni (2), Cu (3)] and [Cd(HL)]n (4), were successfully structured based on imidazole carboxylic acid ligands [H3L = 5-(((1H-imidazol-2-yl)methyl)amino) isophthalic acid]. X-ray single-crystal diffraction analysis showed that MOFs 1–3 possess the same two-dimensional (2D) planar structure, while MOF 4 exhibited a three-dimensional (3D) coordination network. The magnetic test results showed that MOFs 1–3 have typically antiferromagnetic behavior. The sensing experimental showed that MOF 4 could be considered as a promising bifunctional fluorescent sensor for Cu2+ and Fe3+ ions with excellent selectivity and sensitivity, and the detection limit were 4.11 μM and 4.89 μM, with Ksv values of 1.37 × 104 M−1 and 1.24 × 104 M−1, respectively. The cycling experiment illustrated the good reusability of the material. In addition, the fluorescence quenching mechanism of MOF 4 was further explored in detail.

Multinuclear coordination compounds constructed by bis-imidazole and azide ligands. Creation of new network structures and an M2L4 cage that includes two anions

Abstract Treatment of the bis-imidazole ligand, bitb, with CuSO4·5H2O, ZnSO4·7H2O, and Co(NO3)2·6H2O in the presence of NaN3 produced [Cu2(μ-N3)2(bitb)(N3)2]n (1), [Zn(bitb)(N3)2]n (2), and [(N3)2 ⊂ Co2(bitb)4(N3)2](Me2CO)2·(H2O)4 (3). Compound 1 is a 2D coordination polymer with {Cu2(μ-N3)2}n chains in the framework. Compound 2 is a 1D coordination polymer with repetitions of the “figure-of-eight-shaped” turns. Compound 3 is an M2L4 cage compound that includes 2 N3− in the cage. Their unprecedented coordination structures are described.

Three multifunctional two-dimensional coordination polymers based on 1-(3-carboxybenzyl)-4,4′-bipyridinium ligand

By utilizing the carboxybenzyl viologen ligand 1-(3-carboxybenzyl)-4,4′-bipyridinium chloride (HBcbpy·Cl), 1,3,5-benzenetricarboxylic acid (H3BTC) and varying different metal ions, three new coordination polymers [Cd(Bcbpy)(HBTC)(H2O)·2H2O]n (1), [Zn(Bcbpy)(HBTC)(H2O)·2H2O]n (2) and [Co2(Bcbpy)2(HBTC)2(H2O)2·4H2O]n (3) have been synthesized and structurally characterized. Compounds 1 and 2 have identical two-dimensional (2D) coordination layered structure, while compound 3 features 2D+2D→2D structure. It is interesting that compounds 1 and 2 exhibit electron transfer photochromism, while compound 3 displays hydrochromism through dehydration. At the same time, considering the high stability and fast photo-response, the photo-modulated fluorescence and the inkless erasable printing capability are investigated.

A Cu3 BHT-Graphene van der Waals Heterostructure with Strong Interlayer Coupling for Highly Efficient Photoinduced Charge Separation.

Two-dimensional van der Waals heterostructures (2D vdWhs) are of significant interest due to their intriguing physical properties critically defined by the constituent monolayers and their interlayer coupling. Synthetic access to 2D vdWhs based on chemically tunable monolayer organic 2D materials remains challenging. Herein, the fabrication of a novel organic-inorganic bilayer vdWh by combining π-conjugated 2D coordination polymer (2DCP, i.e., Cu3 BHT, BHT = benzenehexathiol) with graphene is reported. Monolayer Cu3 BHT with detectable µm2 -scale uniformity and atomic flatness is synthesized using on-water surface chemistry. A combination of diffraction and imaging techniques enables the determination of the crystal structure of monolayer Cu3 BHT with atomic precision. Leveraging the strong interlayer coupling, Cu3 BHT-graphene vdWh exhibits highly efficient photoinduced interlayer charge separation with a net electron transfer efficiency of up to 34% from Cu3 BHT to graphene, superior to those of reported bilayer 2D vdWhs and molecular-graphene vdWhs. This study unveils the potential for developing novel 2DCP-based vdWhs with intriguing physical properties.

A 3D coordination polymer of Cd(II) with conformationally flexible mixed ligands as an active filler for silicone elastomers

The electronic configuration of d10 metals enables for a wide range of coordination numbers and geometries which, together with the use of mixtures of ligands for their coordination, allows fine-tuning of the properties of the complexes formed. By treating Cd(ClO4)2 with 1,3-bis(carboxypropyl)tetramethyldisiloxane (H2Cx) and 4,4′-azopyridyne (AzPy) in solution, a 3D coordination polymer, [Cd(Cx)(AzPy)·1.85H2O]n (1), was mostly formed. The compound was investigated by elemental and spectral analysis, as well as by powder and single crystal X-ray diffraction. Thermal behavior of compound 1 was evaluated by TGA and DSC, while the moisture behavior was studied by dynamic vapor sorption (DVS) analysis. Compound 1 contains a five-dentate Cx2− ligand with Cd atoms in a pentagonal-bipyramidal geometry, as determined by X-ray analysis. The conformational flexibility of the ligands allows the establishment of all possible intermolecular interactions in a very dense packing, the resulting structure having an extremely low free volume (14.8%). The compound is hydrophobic, adsorbing up to 2.4 wt% water vapor, thermally stable up to 160 °C, and has a phase transition around 6 °C, which, based on analysis by polarized optical microscopy (POM), is considered as a second-order crystal-to-crystal transition, facilitated by the mobility of the siloxane fragment. Due to the constraints imposed by the covalent 3D architecture, the conformational photoisomerization of 1 is extremely limited, as indicated by UV–Vis spectroscopy studies on solutions with solvents of different polarities as well as dielectric spectroscopy studies on silicone composites in which it is in solid state with 5 and 20 wt% loading. Instead, it was found that compound 1 significantly increases the dielectric strength of the resulting materials (up to 46 V/μm compared to 18 V/μm in the empty matrix) by incorporating it as a filler, making them suitable for dielectric elastomer generators, as the results of theoretical calculations indicate. In the purification process, a 2D coordination polymer, [Cd(Cx)(AzPy)·H2Cx]n (2), was also identified in traces.

Alloxazine-Based Ligands Appended with Coordinating Groups: Synthesis, Electrochemical Studies, and Formation of Coordination Polymers.

Three new ligands based on the alloxazine core appended with pyridyl coordinating groups have been designed, synthesized, and characterized. The ligands are revealed to be redox-active in DMF solution, as attested to by CV and combined CV/EPR studies. The spin of the reduced species appears to be delocalized on the alloxazine core, as attested to by DFT calculations. The coordination abilities of one of the ligands toward Cu2+ or Ni2+ 3d cations revealed the formation of the first alloxazine-based 3D coordination polymers, presenting strong π-π stacking and substantial cavities. Preliminarily charge/discharge experiments in Li batteries evidence Li+ insertion in such systems.

Two 3D Zn(II)/Co(II)-CPs as fluorescent sensors for turn-on and red-shift sensing of tryptophan and norfloxacin

Two three-dimensional (3D) coordination polymers (CPs), namely {[M(seb)(bbimb)]·3H2O}n (M = Zn for 1; Co for 2), were obtained via hydrothermal method using sebacic acid (H2seb) mixed with 1,4-bis(benzoimidazol-1-yl)butane (bbimb). The structures of 1 and 2 both display as 3D frameworks with a 5-fold interpenetrating dia topology. CPs 1 and 2 both exhibit excellent luminescent properties and good water stability. Fluorescence sensing experiments demonstrate that 1 and 2 both can selectively detect tryptophan (Trp) and norfloxacin (Nor) in aqueous solution through turn-on and red-shift effect with remarkable anti-interference ability and low detection limits. The limits of detection (LOD) toward Trp-and Nor are 0.07 μM, 0.08 μM for 1 and 0.41 μM, 0.11 μM for 2. In addition, theoretical calculations and different detection methods were utilized to thoroughly investigate the potential sensing mechanisms for Trp-and Nor. Importantly, 1 and 2 represent two rare examples for sensing both Trp-and Nor via turn-on and red-shift effects. The fluoresence test films of 1 and 2 were prepared which can detect Trp-and Nor quickly with naked eye.

Iodine Adsorption-Desorption-Induced Structural Transformation and Improved Ag+ Turn-On Luminescent Sensing Performance of a Nonporous Eu(III) Metal-Organic Framework.

Posttreatment of pristine metal-organic frameworks (MOFs) with suitable vapor may be an effective way to regulate their structures and properties but has been less explored. Herein, we report an interesting example in which a crystalline nonporous Eu(III)-MOF was transferred to a porous amorphous MOF (aMOF) via iodine vapor adsorption-desorption posttreatment, and the resulting aMOF showed improved turn-on sensing properties with respect to Ag+ ions. The crystalline Eu-MOF, namely, Eu-IPDA, was assembled from Eu(III) and 4,4'-{4-[4-(1H-imidazol-1-yl)phenyl]pyridine-2,6-diyl}dibenzoic acid (H2IPDA) and exhibited a two-dimensional (2D) coordination network based on one-dimensional secondary building blocks. The close packing of the 2D networks gives rise to a three-dimensional supramolecular framework without any significant pores. Interestingly, the nonporous Eu-IPDA could absorb iodine molecules when Eu-IPDA crystals were placed in iodine vapor at 85 °C, and the adsorption capacity was 1.90 g/g, which is comparable to those of many MOFs with large BET surfaces. The adsorption of iodine is attributed to the strong interactions among the iodine molecule, the carboxy group, and the N-containing group and leads to the amorphization of the framework. After immersion of the iodine-loaded Eu-IPDA in EtOH, approximately 89.7% of the iodine was removed, resulting in a porous amorphous MOF, denoted as a-Eu-IPDA. In addition, the remaining iodine in the a-Eu-IPDA framework causes strong luminescent quenching in the fluorescence emission region of the Eu(III) center when compared with that in Eu-IPDA. The luminescence intensity of a-Eu-IPDA in water suspensions was significantly enhanced when Ag+ ions were added, with a detection limit of 4.76 × 10-6 M, which is 1000 times that of pristine Eu-IPDA. It also showed strong anti-interference ability over many common competitive metal ions and has the potential to sense Ag+ in natural water bodies and traditional Chinese medicine preparations. A mechanistic study showed that the interactions between Ag+ and the absorbed iodine, the carboxylate group, and the N atoms all contribute to the sensing performance of a-Eu-IPDA.

Mn(II) 3D Coordination Framework with Mixed 5-Aminoisophthalato and Pyridyl-isonicotinoyl Hydrazone Bridges: Structure, Electrical Conductivity, Anticancer Activity, and Drug Delivery

Mn(II) 3D Coordination Framework with Mixed 5-Aminoisophthalato and Pyridyl-isonicotinoyl Hydrazone Bridges: Structure, Electrical Conductivity, Anticancer Activity, and Drug Delivery

Gray correlation analysis between mechanical performance and pore characteristics of permeable concrete

Pervious concrete is a type of sustainable construction material used in pavement engineering due to its advantages in water permeability, skid resistance, and sound absorption performance. This study investigated the pore characteristics of five types of pervious concrete, along with the uniaxial compression behaviors and semi-circular bending (SCB) fracture performance. The critical stress intensity factor was obtained using the equivalent energy approach. Gray relational analysis was conducted between the mechanical performance and the pore characteristics. Pore indicators include the effective porosity, 2D porosity along the specimen height, 2D coordination number (CN) along the specimen height, 2D pore radius, 2D specific surface area, 3D CN, 3D pore radius, and 3D virtual porosity. Results indicated that from M1 to M3, when cement mortar content decreased from 520 kg/m3 to 408 kg/m3, the effective porosity increased from 18.95% to 27.43%, and the compressive strength and fracture toughness decreased obviously. For the same type of pervious concrete mixture, with the increase of notch length, the critical stress intensity factor decreased accordingly. The 2D porosity distribution, 2D pore size distribution, and 2D CN distribution presented a symmetrical trend of decreasing, then increasing, and then decreasing with the increase of specimen height. Aggregate with the gradation within the range of 9.5 mm to 19.0 mm generated a higher compressive strength, larger effective porosity and larger pore size compared to the gradation of 4.75 mm∼9.5 mm. The results of CN and pore radius generated from the 3D pore network model were larger than the corresponding 2D values. The gray correlation analysis revealed that 2D pore radius and 3D pore radius played critical effects on the uniaxial compressive strength and fracture resistance, while 2D CN and 3D CN were the least significant factors affecting the mechanical performance.

3D-Cobalt-Dicyanamide-Derived 2D-Layered-Co(OH)2-Based Catalyst for Light-Driven Hydrogen Evolution.

Derivation of 3D coordination polymers to produce active catalysts has been a feasible strategy to achieve a precise coordination sphere for the catalytic site. This study demonstrates the partial conversion of a 3D cobalt dicyanamide coordination polymer, Co-dca, to a 2D layered hydroxide-oxyhydroxide structure under photocatalytic conditions. The catalyst exhibits an activity as high as 28.3 mmol h-1 g-1 in the presence of a [Ru(bpy)3]2+/triethylamine (TEA) couple to maintain it for at least 12 h. Photocatalytic and characterization studies reveal that the dicyanamide ligand within the coordination polymer is crucial for governing modification and achieving a superior H2 evolution rate. Moreover, we observed the critical role of TEA as the hydrolyzing agent for the transformation process. This study displays that the metal dicyanamides can be utilized as templates for preparing active and robust catalysts.

A novel 4,4′-hexafluoroisoprorylidene-diphthalhydrazidate-bridged 3D coordination polymer of Pb(II): Hydrothermal in situ synthesis, structural characterization and photocatalytic property

A new coordination polymer photocatalyst, [Pb(FDPTH)(phen)] (1; FDPTH 4,4′ hexafluoroisoprorylidene-diphthalhydrazidate, phen = 1,10-phenanthroline) was synthesized for the frist time. The FDPTH ligand was obtained by the in situ acylation reactions between 4,4′-(hexafluoroisopropylidene)diphthalic anhydride (6-FDCA) and N2H4·H2O for the first time. X-ray single-crystal diffraction analysis showed that FDPTH ligands have a μ4-bridging mode in compound 1, which linking Pb(II) centers to create a 3D network structure. Hirshfeld surface analysis was used to investigate the crystal packing and interactions of compound 1. The catalytic activity of compound 1 for methylene blue (MB) was tested under visible light. The degradation for MB followed a pseudo-first-order kinetic pattern and remained efficient after repeated experimental runs. The active species in catalytic process were discovered by radical trapping experiments. The band gap of compound 1 was determined via UV-vis absorbance spectra and Mott-Schottky plot, and a photocatalytic mechanism was proposed for the degradation process.

3D Coordination Polymers with N-Heterocyclic Ga(I) Moieties

3D Coordination Polymers with N-Heterocyclic Ga(I) Moieties

Anticancer Drug Extraction from Plasma Samples Using Three-Dimensional Polyoxometalate-Based Supramolecular Frameworks as Sorbents.

Four self-assembled inorganic-organic hybrid materials, namely, H{Na(H2O)3[Gd(PDA)(H2O)2]3[BW12O40]}·4H2O (1), H{Na(H2O)3[Tb(PDA)(H2O)2]3[BW12O40]}·3H2O (2), H{Na(H2O)3[Er(PDA)(H2O)3]3[BW12O40]}·H2O (3) (PDA = 1,10-phenanthroline-2,9-dicarboxylate), and [Pr3(H2O)13(pydc-OH)2][BW12O40]·12H2O (4) (pydc-OH = 4-hydroxy-2,6-pyridinedicarboxylate), were hydrothermally synthesized and structurally characterized. Hybrids 1-3 are isostructural and contain a Keggin unit, which is linked to lanthanoids to produce distinct trinuclear lanthanoid building blocks. The fragments are connected by anion-π and hydrogen bonding interactions to create 3D networks. In hybrid 4, a trimeric Pr-organic species bearing a Keggin unit forms a 2D coordination polymer, and then hydrogen bonding interactions between 2D layers lead to the formation of a 3D structure. These polyoxometalate-based frameworks were used as sorbents for the dispersive microsolid-phase extraction (D-μSPE) of two anticancer drugs (doxorubicin and epirubicin) in human plasma samples. Analytes were quantified and separated using high-performance liquid chromatography with fluorescence detection (HPLC-FLD). The method's linearity was between 0.8-500 ng mL-1 and 1.0-500 ng mL-1 for the antineoplastic drugs doxorubicin and epirubicin, respectively. The limits of detection (S/N = 3) were in the range of 0.2-0.3 ng mL-1, while the precision was in the range of 3.5-4.3%. Finally, human plasma samples from patients treated with doxorubicin or epirubicin were analyzed by using the D-μSPE-HPLC-FLD method.

Interplay of bipyridine and 4,4′-diaminodiphenylmethane ligands in crystal design of cadmium-based coordination polymers: Structures and unusual photoluminescence quenching

Starting from Cd(ClO4)2·2H2O, four positively charged coordination polymers were prepared and characterized by IR spectroscopic and single-crystal X-ray diffraction methods. The obtained crystalline solids included one-dimensional coordination polymers, {[Cd(dadpm)(2,2′-bpy)2](ClO4)2}n (1), and {[Cd(dadpm)(2,2′-bpy)2](ClO4)2·0.5(H2O)}n (2), and two-dimensional coordination polymers, {[Cd(4,4′-bpy)2(H2O)2](ClO4)2(dadpm)2}n (3), and {[Cd(4,4′-bpy)2(H2O)2](ClO4)2(4,4′-bpy)0.5(dadpm)·EtOH}n (4) (dadpm = 4,4′-diaminodiphenylmethane, 2,2′-bpy = 2,2′-bipyridine; 4,4′-bpy = 4,4′-bipyridine). The similar one-dimensional coordination backbones in 1 and 2 were originated from the mononuclear Cd(II) coordination cores with the N6 distorted octahedral geometries going from two terminal bidentate-chelate 2,2′-bpy and two bidentate-bridging dadpm ligands that mediated the successive metal atoms in coordination chains. The charge-balanced perchlorate anions were located in the interchain space complemented by water molecules in 2. The coordination chains were interconnected into H-bonded networks via NH(NH2)⋯O hydrogen bonds. The 2D coordination polymers 3 and 4 comprised the same positively charged square-grid infinite networks {[Cd(4,4′-bpy)2(H2O)2]2+}n with sql topology and with cadmium atom in the N4O2 tetragonally distorted octahedral coordination geometry as a single node. The charge-compensated ClO4− anions and the dadpm molecules were located in the interlayer space in 3 being complemented by the 4,4′-bpy and EtOH molecules in 4. The solid-state photoluminescence in all reported coordination polymers was significantly attenuated and redistributed along the spectrum in comparison with the pure dadpm which revealed the dual emission in the form of a strong narrow signal in the ultraviolet and a weak signal in the yellow regions of spectrum.

A Two-dimensional Metal-Organic Framework as Promising Cathode for Advanced Lithium Storage.

Anthraquinone electrode materials are promising candidates for lithium-ion batteries (LIBs) due to the abundance of anthraquinone and the high theoretical capacity, and good reversibility of the anthraquinone electrodes. However, the active anthraquinone materials are soluble in organic electrolytes, resulting in a sharp decay of capacity during the charge and discharge processes. Herein, we report on a two-dimensional calcium anthraquinone 2,3-dicarboxy metal-organic framework (2D CaAQDC MOF) fabricated using a simple hydrothermal method. The 2D CaAQDC MOF not only effectively inhibits the dissolution of active electrode substances into the electrolyte, but also promotes the diffusion of lithium ion into the pores of the MOF. When used as a cathode for the LIBs, the resulting CaAQDC electrode delivers a high specific capacity of ~100 mAh g-1 at a current density of 50 mA g-1 after 200 cycles, demonstrating its good cycle stability. Even at a high current density of 200 mA g-1 , the CaAQDC electrode exhibits a specific capacity of ~60 mAh g-1 . The fabricated 2D coordination polymers effectively restrains the dissolution of anthraquinone into the organic electrolyte and enhances the structural stability, which greatly improves the electrochemical performance of anthraquinone. These research results offer a rational molecular design strategy to address the dissolution of this and other active organic electrode materials.

Eu3+ -Directed Supramolecular Metallogels with Reversible Quadruple-Stimuli Response Behaviors.

Smart luminescent materials that have the ability to reversibly adapt to external environmental stimuli and possess a wide range of responses are continually emerging, which place higher demands on the means of regulation and response sites. Here, europium ions (Eu3+ )-directed supramolecular metallogels are constructed by orthogonal self-assembly of Eu3+ based coordination interactions and hydrogen bonding. A new organic ligand (L) is synthesized, consisting of crown ethers and two flexible amide bonds-linked 1,10-phenanthroline moieties to coordinate with Eu3+ . Synergistic intermolecular hydrogen bonding in L and Eu3+ -L coordination bonding enable Eu3+ and L to self-assemble into shape-persistent 3D coordination metallogels in MeOH solution. The key to success is the utilization of crown ethers, playing dual roles of acting both as building blocks to build L with C2 -symmetrical structure, and as the ideal monomer for increasing the energy transfer from L to Eu3+ 's excited state, thus maintaining the excellent luminescence of metallogels. Interestingly, such assemblies show K+ , pH, F- , and mechano-induced reversible gel-sol transitions and tunable luminescence properties. Above findings are useful in the studies of molecular switches, dynamic assemblies, and smart luminescent materials.

Succinato-bridged Cd(II)-nicotinylhydrazone 3D coordination polymer: structure, photoconductivity and computational studies

Strategies for clean energy are important components of the United Nation’s Sustainable Development Goals (SDGs). To this end, we have studied the conductivity of a Cd(II)-based 3D coordination polymer, [Cd(succ)(pcih)(H2O)]n (1) (H2succ = succinic acid; pcih = pyridine-4-carboxaldehyde iso-nicotinoyl hydrazone). Compound 1 was structurally characterized by single-crystal X-ray diffraction. The bridging groups, succ2 − and pcih, self-assembled via H-bonding and π∙∙∙π interactions. The optical band gap calculated from a Tauc’s plot was determined to be 3.71 eV which is consistent with semiconducting behavior. The experimental barrier height, 0.71 eV (dark phase); 0.49 eV (light phase) and series resistance, 358.48 Ω (dark); 133.73 Ω (light), also support the photoinduced enhancement of conductivity. The non-ohmic relation, I α V2, showed an enhancement of conductivity by 2.5 times upon light irradiation [3.36 × 10−6 S m−1 (dark) and 8.37 × 10−6 S m−1 (light)]. DFT computations employing the crystallographic parameters of 1 indicated a HOMO/LUMO energy gap of 4.06 eV, within the range of semiconducting materials. The optical stability of 1 was examined by fluorescence measurements and lifetime data.