The three-dimensional structure of 3, 3′, 5′-trichloro-4-methoxybiphenyl, a "coplanar" polychlorinated biphenyl (PCB) derivative

Hans Joachim Lehmler; Sean Parkin; Larry W. Robertson

doi:10.1016/S0045-6535(01)00177-1

The three-dimensional structure of 3, 3′, 5′-trichloro-4-methoxybiphenyl, a "coplanar" polychlorinated biphenyl (PCB) derivative

Hans Joachim Lehmler
, Sean Parkin
, Larry W. Robertson

Chemistry

Research output: Contribution to journal › Article › peer-review

20 Scopus citations

Abstract

The crystal structure of a "coplanar" polychlorinated biphenyl (PCB) derivative, 4-methoxy-3, 3′, 5′-trichlorobiphenyl (C₁₃H₉Cl₃O), is described. The torsion angle of the title compound is 41.31(07)°, which is in good agreement with the calculated torsion angle of 38.2° in aqueous solution.

Original language	English
Pages (from-to)	485-488
Number of pages	4
Journal	Chemosphere
Volume	46
Issue number	3
DOIs	https://doi.org/10.1016/S0045-6535(01)00177-1
State	Published - 2002

Funding

Funders	Funder number
National Institute of Environmental Health Sciences (NIEHS)	P42ES007380

Keywords

Biaryls
Crystal structure
Environmental contaminants
PCB

ASJC Scopus subject areas

Environmental Engineering
Environmental Chemistry
General Chemistry
Pollution
Health, Toxicology and Mutagenesis

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10.1016/S0045-6535(01)00177-1

Cite this

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title = "The three-dimensional structure of 3, 3′, 5′-trichloro-4-methoxybiphenyl, a {"}coplanar{"} polychlorinated biphenyl (PCB) derivative",

abstract = "The crystal structure of a {"}coplanar{"} polychlorinated biphenyl (PCB) derivative, 4-methoxy-3, 3′, 5′-trichlorobiphenyl (C13H9Cl3O), is described. The torsion angle of the title compound is 41.31(07)°, which is in good agreement with the calculated torsion angle of 38.2° in aqueous solution.",

keywords = "Biaryls, Crystal structure, Environmental contaminants, PCB",

author = "Lehmler, \{Hans Joachim\} and Sean Parkin and Robertson, \{Larry W.\}",

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language = "English",

volume = "46",

pages = "485--488",

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T1 - The three-dimensional structure of 3, 3′, 5′-trichloro-4-methoxybiphenyl, a "coplanar" polychlorinated biphenyl (PCB) derivative

AU - Lehmler, Hans Joachim

AU - Parkin, Sean

AU - Robertson, Larry W.

PY - 2002

Y1 - 2002

N2 - The crystal structure of a "coplanar" polychlorinated biphenyl (PCB) derivative, 4-methoxy-3, 3′, 5′-trichlorobiphenyl (C13H9Cl3O), is described. The torsion angle of the title compound is 41.31(07)°, which is in good agreement with the calculated torsion angle of 38.2° in aqueous solution.

AB - The crystal structure of a "coplanar" polychlorinated biphenyl (PCB) derivative, 4-methoxy-3, 3′, 5′-trichlorobiphenyl (C13H9Cl3O), is described. The torsion angle of the title compound is 41.31(07)°, which is in good agreement with the calculated torsion angle of 38.2° in aqueous solution.

KW - Biaryls

KW - Crystal structure

KW - Environmental contaminants

KW - PCB

UR - https://www.scopus.com/pages/publications/0036147457

UR - https://www.scopus.com/pages/publications/0036147457#tab=citedBy

U2 - 10.1016/S0045-6535(01)00177-1

DO - 10.1016/S0045-6535(01)00177-1

M3 - Article

C2 - 11829405

AN - SCOPUS:0036147457

SN - 0045-6535

VL - 46

SP - 485

EP - 488

JO - Chemosphere

JF - Chemosphere

IS - 3

ER -

The three-dimensional structure of 3, 3′, 5′-trichloro-4-methoxybiphenyl, a "coplanar" polychlorinated biphenyl (PCB) derivative

Abstract

Funding

Keywords

ASJC Scopus subject areas

Access to Document

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