Sample Originator: Simon J. Colesa.
Data Collection: Simon J. Colesa
Structure Determination: Simon J. Colesa and Michael B. Hursthousea.
University of Southamptona
C8H4N2Cl2
InChI=1/C8H4Cl2N2/c9-7-8(10)12-6-4-2-1-3-5(6)11-7/h1-4H
| Identification Number: | 10.5258/ecrystals/314 |
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| Date Created: | 25 May 2007 |
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| Deposited On: | 21 Jan 2008 15:30 |
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| Deposited By: | Dr Simon J Coles |
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Data collection parameters
| Chemical formula | C8 H4 Cl2 N2 |
| Crystal morphology | Block |
| Crystal system | Monoclinic |
| Space group symbol | C2/c |
| Cell length a | 3.8278(2) |
| Cell length b | 18.9050(12) |
| Cell length c | 10.8874(6) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 95.649(4) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0435 |
| R Factor (Obs) | 0.0279 |
| R Factor (All) | 0.0311 |
| Weighted R Factor (Obs) | 0.0693 |
| Weighted R Factor (All) | 0.0717 |
Citation: Coles, Simon J. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/314)
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