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(Z)-2-(2-Chloro-3,3,3-trifluoro-prop-1-en-yl)-6-methoxy-phenyl acetate.

ABSTRACT: The crystal structure of the title compound, C(12)H(10)ClF(3)O(3), was determined in order to establish the configuration of the C=double bond. The compound was found to be the Z isomer. The crystal structure is dominated by Cl?O halogen bonds [Cl?O = 3.111?(3)?Å], as well as C-H?O and C-H?F hydrogen-bonding inter-actions, that connect neighboring mol-ecules into a three-dimensional supra-molecular network.

SUBMITTER: Zhou H

PROVIDER: S-EPMC2961540 | biostudies-literature | 2008 May

REPOSITORIES: biostudies-literature

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(Z)-2-(2-Chloro-3,3,3-trifluoro-prop-1-en-yl)-6-methoxy-phenyl acetate.

Zhou Hua H Li Zhi-Gang ZG Xu Jing-Wei JW

Acta crystallographica. Section E, Structure reports online 20080530 Pt 6

The crystal structure of the title compound, C(12)H(10)ClF(3)O(3), was determined in order to establish the configuration of the C=double bond. The compound was found to be the Z isomer. The crystal structure is dominated by Cl⋯O halogen bonds [Cl⋯O = 3.111 (3) Å], as well as C-H⋯O and C-H⋯F hydrogen-bonding inter-actions, that connect neighboring mol-ecules into a three-dimensional supra-molecular network. ...[more]

PMID: 21202673

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