CIS-ACONITIC ACID AT 150 K

Authors
NAGEL N ENDRUSCHAT U BOCK H
Citation
N. Nagel et al., CIS-ACONITIC ACID AT 150 K, Acta crystallographica. Section C, Crystal structure communications, 52, 1996, pp. 2912-2915
Citations number
16
Categorie Soggetti
Crystallography
Journal title
Acta crystallographica. Section C, Crystal structure communications → ACNP
ISSN journal
01082701
Volume
52
Year of publication
1996
Part
11
Pages
2912 - 2915
Database
ISI
SICI code
0108-2701(1996)52:<2912:CAA1K>2.0.ZU;2-L
Abstract
cis-Aconitic acid (cis-1-propene-1,2,3-tricarboxylic acid, C6H6O6) cry stallizes with an intramolecular hydrogen bond between the two carboxy lic acid groups linked by the C double bond C double bond and exhibits a complex intermolecular hydrogen-bond pattern. The two carboxylic ac id groups involved in the intramolecular hydrogen bond are coplanar wi th the propene skeleton, while the third carboxylic group is twisted o ut of this plane with a dihedral angle of 66.21 (9)degrees.