Abstract
The investigation of bonding interactions between superatoms continues to be a largely unexplored area of study. In this study, we present the synthesis and characterization of two F2-type superatomic molecules [Au2Ag25(C7H4NOS)13(DPPB)3] and [Au9Ag18(C5H4NS)11(DPPM)5]2+ (Au2Ag25 and Au9Ag18 for short, respectively). The overall structures were confirmed via X-ray crystallography, revealing the horizontal expansion of the biicosahedral Au2Ag21 yielding [Au2Ag25(C7H4NOS)13(DPPB)3] and vertical expansion of the biicosahedral Au8Ag15 yielding [Au9Ag18(C5H4NS)11(DPPM)5]2+. Furthermore, their electronic structures were elucidated through density functional theory (DFT) calculations. Spectroscopic analysis of electronic absorption characteristics, in conjunction with Tamm-Dancoff approximation DFT (TDA-DFT) calculations, revealed that the Au2Ag21(+9) and Au8Ag15(+9) cores were analogues of the F2 molecule in electronic configuration.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callDisclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
