A single crystal of Imidazolium Hydrogen Adipate Monohydrate (IHAM) has been obtained by the slow evaporation technique. The grown crystal belongs to the Triclinic crystal system. The spectral studies were further used to confirm the structure. The Hirshfeld analysis suggests that the major bonding in the crystal occurs through the Hydrogen atom constituting 69 % of the total bonding. The Void analysis shows a lower percentage of voids suggesting that the crystal is strongly packed. The optical constants such as optical and electrical conductivity, optical susceptibility and extinction coefficient were elucidated from the UV–Vis-NIR analysis. The refractive index of IHAM was determined to be 1.391 by the Prism Coupler. The work-hardening coefficient of the title compound was found to be 1.14 which classifies the material as hard. The hardness number shows the normal Indentation Size Effect (ISE). The electrical characteristics were studied by using the dielectric analyser. The solid-state parameters such as the Fermi gap, Penn gap and optical electronegativity were calculated based on the dielectric parameters. The electronic polarizability calculated by different methods is in mutual agreement. The TG/DTA analysis suggests that the material is suitable for applications up to 79 °C. The Z-Scan analysis confirms the Reverse Saturable Absorption behaviour. The third-order nonlinear susceptibility was calculated as 9.77×10−9 esu.