GAMMA-RESORCYCLIC ACID, ITS MONOHYDRATE AND ITS PYRIDINIUM COMPLEX

被引:30
作者
GDANIEC, M [1 ]
GILSKI, M [1 ]
DENISOV, GS [1 ]
机构
[1] ST PETERSBURG STATE UNIV,INST PHYS,ST PETERSBURG 198904,RUSSIA
关键词
D O I
10.1107/S0108270194000557
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The crystal structures of gamma-resorcyclic acid (2,6-dihydroxybenzoic acid), C7H6O4, (I), gamma-resorcylic acid monohydrate, C7H6O4.H2O, (II), and pyridinium gamma-resorcyulate, C5H6N+.C7H5O4-, (III), have been determined. In (I) and (II), the carboxyl group of the gamma-resorcylic acid molecule is in an anti conformation and the carboxylic OH group is involved as a donor in an O-H...O intramolecular hydrogen bond. This bond is part of an infinite hydrogen-bonded chain with mixed sigma- and pi-bond cooperativity. Structure (II) is disordered and may be considered to result from the superposition of two lower-symmetry structures related by a mirror plane. Structure (III) consists of discrete complex units formed from the anion and cation by means of an N-H...O hydrogen bond.
引用
收藏
页码:1622 / 1626
页数:5
相关论文
共 7 条
[1]   X-RAY, FT-IR AND PM3 STUDIES OF HYDROGEN-BONDS IN COMPLEXES OF SOME PYRIDINES WITH TRIFLUOROACETIC-ACID [J].
DEGASZAFRAN, Z ;
GDANIEC, M ;
GRUNDWALDWYSPIANSKA, M ;
KOSTURKIEWICZ, Z ;
KOPUT, J ;
KRZYZANOWSKI, P ;
SZAFRAN, M .
JOURNAL OF MOLECULAR STRUCTURE, 1992, 270 :99-124
[2]  
GOLUBEV NS, 1992, J MOL STRUCT, V272, P263
[3]  
Jeffrey GA., 1991, HYDROGEN BONDING BIO
[4]  
KUMA, 1991, KUMA KM 4 USERS GUID
[5]   PHASE ANNEALING IN SHELX-90 - DIRECT METHODS FOR LARGER STRUCTURES [J].
SHELDRICK, GM .
ACTA CRYSTALLOGRAPHICA SECTION A, 1990, 46 :467-473
[6]  
SHELDRICK GM, 1994, UNPUB J APPL CRYST
[7]  
SIEMENS, 1989, STEREOCHEMICAL WORKS