Open AccessStructural, Spectroscopic and Hirshfeld Surface Analysis of Anilinium Malonate
Author(s) -
F. Mary Anjalin,
N. Kanagathara,
M.K. Marchewka,
T. Srinivasan
Publication year - 2019
Publication title -
asian journal of chemistry/asian journal of chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.145
H-Index - 34
eISSN - 0975-427X
pISSN - 0970-7077
DOI - 10.14233/ajchem.2019.21839
Subject(s) - malonate , monoclinic crystal system , chemistry , malonic acid , crystallography , crystal structure , crystal (programming language) , raman spectroscopy , single crystal , infrared spectroscopy , evaporation , infrared , organic chemistry , optics , physics , computer science , thermodynamics , programming language
The comprehensive elucidation of the crystal structure, vibrational and Hirshfeld surface analysis of new crystalline product anilinium malonate C6H5NH3 +. C3H3O4 – are presented in this communication. Single crystals of anilinium malonate have been grown by the method of slow evaporation at room temperature. Single crystal XRD study has been carried out to study the structural properties of the grown crystal and it reveals that the crystal crystallizes in the monoclinic system with centrosymmetric space group P2(1)/n. Room temperature powder infrared and Raman spectra of the aniline malonic acid molecular complex (1:1) were carried out. All the characteristic frequencies present in the crystal gives the notable vibrational effect. Hirshfeld surface analysis has been carried out to know the intercontact between the atoms in the structure of the grown crystal.