Sample Originator: Terry L. Threlfalla.
Data Collection: Susanne L. Hutha
Structure Determination: Susanne L. Hutha and Michael B. Hursthousea.
University of Southamptona
C13H10Cl2N2O
InChI=1/C13H10Cl2N2O/c14-9-1-5-11(6-2-9)16-13(18)17-12-7-3-10(15)4-8-12/h1-8,16-17H/q-1
| Identification Number: | 10.5258/ecrystals/682 |
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| Date Created: | 20 July 2008 |
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| Deposited On: | 03 Apr 2009 11:24 |
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| Deposited By: | Mrs L. Susanne Coles (née) Huth |
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Data collection parameters
| Chemical formula | C13 H10 Cl2 N2 O |
| Crystal morphology | Sheet |
| Crystal system | Monoclinic |
| Space group symbol | C2/c |
| Cell length a | 27.097(6) |
| Cell length b | 4.5781(7) |
| Cell length c | 9.9007(19) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 96.281(8) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0481 |
| R Factor (Obs) | 0.0714 |
| R Factor (All) | 0.0969 |
| Weighted R Factor (Obs) | 0.1602 |
| Weighted R Factor (All) | 0.1774 |
Citation: Huth, Susanne L. and Threlfall, Terry L. and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/682)
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