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Bifenox: methyl 5-(2,4-di-chloro-phen-oxy)-2-nitro-benzoate.

ABSTRACT: In the title compound, the herbicide bifenox, C14H9Cl2NO5, the dihedral angle between the dichlorobenzene and nitro-benzene rings is 78.79?(14)°. In the crystal, C-H?O hydrogen bonds give rise to a three-dimensional network structure in which there are both a ?-? inter-action [ring centroid separation = 3.6212?(16)?Å] and a C-Cl?? inter-action [Cl?ring centroid = 3.4754?(8)?Å]. In addition, short Cl?Cl contacts [3.3767?(11) and 3.3946?(11)?Å] are present.

SUBMITTER: Jeon Y

PROVIDER: S-EPMC3793716 | biostudies-literature | 2013

REPOSITORIES: biostudies-literature

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Bifenox: methyl 5-(2,4-di-chloro-phen-oxy)-2-nitro-benzoate.

Jeon Youngeun Y Kim Jineun J Cho Seonghwa S Kim Tae Ho TH

Acta crystallographica. Section E, Structure reports online 20130706 Pt 8

In the title compound, the herbicide bifenox, C14H9Cl2NO5, the dihedral angle between the dichlorobenzene and nitro-benzene rings is 78.79 (14)°. In the crystal, C-H⋯O hydrogen bonds give rise to a three-dimensional network structure in which there are both a π-π inter-action [ring centroid separation = 3.6212 (16) Å] and a C-Cl⋯π inter-action [Cl⋯ring centroid = 3.4754 (8) Å]. In addition, short Cl⋯Cl contacts [3.3767 (11) and 3.3946 (11) Å] are present. ...[more]

PMID: 24109303

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