Journal article
The three-dimensional structure of 3,3′,4,4′-tetrachlorobiphenyl, a dioxin-like polychlorinated biphenyl (PCB)
Chemosphere (Oxford), Vol.70(9), pp.1694-1698
2008
DOI: 10.1016/j.chemosphere.2007.07.017
PMCID: PMC2430941
PMID: 17723240
Abstract
The crystal structure of PCB 77 (3,3′,4,4′-tetrachlorobiphenyl, C
12H
6Cl
4), a dioxin-like PCB congener, is described. The dihedral angle of PCB 77 is 43.94(6)°, which is slightly larger than calculated or experimental dihedral angles of biphenyl derivatives in solution but smaller than experimental dihedral angles in the gas phase.
Details
- Title: Subtitle
- The three-dimensional structure of 3,3′,4,4′-tetrachlorobiphenyl, a dioxin-like polychlorinated biphenyl (PCB)
- Creators
- Nadim S Shaikh - The University of Iowa, Department of Occupational and Environmental Health, 100 Oakdale Campus, 124 IREH, Iowa City, IA 52242-5000, USASean Parkin - University of Kentucky, Department of Chemistry, Lexington, KY 40506-0055, USAGregor Luthe - The University of Iowa, Department of Occupational and Environmental Health, 100 Oakdale Campus, 124 IREH, Iowa City, IA 52242-5000, USAHans-Joachim Lehmler - The University of Iowa, Department of Occupational and Environmental Health, 100 Oakdale Campus, 124 IREH, Iowa City, IA 52242-5000, USA
- Resource Type
- Journal article
- Publication Details
- Chemosphere (Oxford), Vol.70(9), pp.1694-1698
- DOI
- 10.1016/j.chemosphere.2007.07.017
- PMID
- 17723240
- PMCID
- PMC2430941
- NLM abbreviation
- Chemosphere
- ISSN
- 0045-6535
- eISSN
- 1879-1298
- Publisher
- Elsevier Ltd
- Language
- English
- Date published
- 2008
- Academic Unit
- Occupational and Environmental Health; Iowa Neuroscience Institute; Iowa Superfund Research Program
- Record Identifier
- 9984001084302771
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