C~14~H~9~BrNO~2~S - C14H9BrNO2S

Sample Originator: Peter J. Skabaraa.

Data Collection: Simon J. Colesb and Michael B. Hursthouseb

Structure Determination: Simon J. Colesb.

University of Strathclydea
University of Southamptonb



Controlled Keywords:polymer chemistry, charge transfer
Date Created:05 August 2005
Deposited On:17 Feb 2010 13:44
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC14 H9 Br N O2 S
Crystal morphologyRod
Crystal systemTriclinic
Space group symbolP-1
Cell length a5.9961(2)
Cell length b10.4374(5)
Cell length c11.9315(6)
Cell angle alpha109.210(2)
Cell angle beta91.493(3)
Cell angle gamma106.256(2)
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0401
R Factor (Obs)0.0395
R Factor (All)0.0747
Weighted R Factor (Obs)0.0866
Weighted R Factor (All)0.1021

Citation: Skabara, Peter J. and Coles, Simon J. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1163/)
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