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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 3-chlorobenzoate
Type
JournalPaper
Keywords
single-crystal X-ray study, T=100 K, mean σ(C-C)=0.002 Å, R factor = 0.038, wR factor = 0.115, data-to-parameter ratio 20.6.
Year
2012
Journal Acta Crystallographica Section E: Structure Reports Online
DOI
Researchers Kaliyaperumal Thanigaimani ، Abbas FarhadiKoutenaei ، Nuridayanti Che Khalib ، ُSuhana Arshed ، َAbdul Razak Ibrahim

Abstract

The 3-chloro­benzoate anion of the title salt, C6H9N2 +·C7H4ClO2 −, is nearly planar with a dihedral angle of 2.44 (13)° 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 7.92 (5)° between the pyridinium and benzene rings. The ion pairs are further connected via N—H⋯O and C—H⋯O hydrogen bonds, forming a two-dimensional network parallel to the bc plane.