3,5-Dichloro-3',4'-dimethoxybiphenyl

Ram Dhakal; Sean Parkin; Hans-Joachim Lehmler

doi:10.1107/s2414314619005182

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3,5-Dichloro-3',4'-dimethoxybiphenyl

Ram Dhakal, Sean Parkin and Hans-Joachim Lehmler

IUCrData, Vol.4(4), p.x190518

04/2019

DOI: 10.1107/s2414314619005182

PMCID: PMC7004253

PMID: 32030358

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Abstract

3,5-Dichloro-3',4'-dimethoxybiphenyl, C H Cl O , is a dihydroxylated metabolite of 3,4-dichlorobiphenyl (PCB 14). The title compound displays π-π stacking interactions between inversion related chlorinated benzene rings, with an inter-planar stacking distance of 3.3695 (17) Å. The dihedral angle between the two benzene rings was 42.49 (6)°. The methoxy groups on the non-chlorinated ring lie essentially in the plane of the benzene ring, with dihedral angles of 4.0 (2)° and -2.07 (19)°.

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Details

Title: Subtitle: 3,5-Dichloro-3',4'-dimethoxybiphenyl
Creators: Ram Dhakal - The University of Iowa, Department of Occupational and Environmental Health, University of Iowa Research Park, Iowa City, IA 52242, USA
Sean Parkin - Department of Chemistry, University of Kentucky, Lexington, KY 40506, USA
Hans-Joachim Lehmler - The University of Iowa, Department of Occupational and Environmental Health, University of Iowa Research Park, Iowa City, IA 52242, USA
Resource Type: Journal article
Publication Details: IUCrData, Vol.4(4), p.x190518
DOI: 10.1107/s2414314619005182
PMID: 32030358
PMCID: PMC7004253
NLM abbreviation: IUCrdata
ISSN: 2414-3146
eISSN: 2414-3146
Publisher: England
Grant note: P42 ES013661 / NIEHS NIH HHS P30 ES005605 / NIEHS NIH HHS R21 ES027169 / NIEHS NIH HHS
Language: English
Date published: 04/2019
Academic Unit: Occupational and Environmental Health; Iowa Neuroscience Institute; Iowa Superfund Research Program
Record Identifier: 9984000921802771

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