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Title: The three-dimensional structure of 3,3',4,4'-tetrachlorobiphenyl, a dioxin-like polychlorinated biphenyl (PCB).

Authors: Shaikh, Nadim S; Parkin, Sean; Luthe, Gregor; Lehmler, Hans-Joachim

Published In Chemosphere, (2008 Feb)

Abstract: The crystal structure of PCB 77 (3,3',4,4'-tetrachlorobiphenyl, C(12)H(6)Cl(4)), a dioxin-like PCB congener, is described. The dihedral angle of PCB 77 is 43.94(6) degrees, 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.

PubMed ID: 17723240 Exiting the NIEHS site

MeSH Terms: No MeSH terms associated with this publication

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