2010pa032 - C13 H6 F5 N

Sample Originator: Terence L. Threlfalla.

Data Collection: Philip D F Adlera

Structure Determination: Philip D F Adlera and Graham J. Tizzarda.

University of Southamptona

C13 H6 F5 N

Identification Number:10.5258/ecrystals/1311
Controlled Keywords:Organic Compounds
Date Created:20 August 2010
Deposited On:28 Mar 2012 13:05
Deposited By:Mr Philip D. F. Adler

Depositor Comments

Compound Code: TLT678/3

Data collection parameters

Chemical formulaC13 H7 F4 N
Crystal morphology
Crystal systemMonoclinic
Space group symbolP21/c
Cell length a11.8955(3)
Cell length b7.1235(2)
Cell length c25.8183(6)
Cell angle alpha90.00
Cell angle beta101.6930(10)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0530
R Factor (All)0.0856
Weighted R Factor (Obs)0.1220
Weighted R Factor (All)0.1422

Citation: Adler, Philip D F and Threlfall, Terence L. and Tizzard, Graham J. (2010) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1311)
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