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Abbas FarhadiKoutenaei

Academic rank: Assistant Professor
ORCID:
Education: PhD.
ScopusId:
Faculty: Science
Address:
Phone: 011-35302494

Research

Title
2-Amino-5-methyl­pyridinium 4-methyl­benzoate
Type
JournalPaper
Keywords
single-crystal X-ray study, T=100 K, mean σ(C-C)=0.001 Å, R factor = 0.043, wR factor = 0.125, data-to-parameter ratio 25.4.
Year
2013
Journal Acta Crystallographica Section E: Structure Reports Online
DOI
Researchers Kaliyaperumal Thanigaimani ، Abbas FarhadiKoutenaei ، ُSuhana Arshed ، َAbdul Razak Ibrahim

Abstract

The 4-methyl­benzoate anion of the title salt, C6H9N2 +·C8H7O2 −, is nearly planar, with a dihedral angle of 6.26 (10)° between the benzene ring and the carboxyl­ate group. In the crystal, the protonated N atom and the 2-amino group of the cation are hydrogen bonded to the carboxyl­ate O atoms of the anion via a pair of N—H⋯O hydrogen bonds with an R 2 2(8) ring motif, forming an approximately planar ion pair with a dihedral angle of 9.63 (4)° between the pyridinium and benzene rings. The ion pairs are further connected via N—H⋯O and weak C—H⋯O hydrogen bonds, forming a two-dimensional network parallel to the bc plane.