Sample Originator: Donated Samplea.
Data Collection: Susanne L. Huthb and Michael B. Hursthouseb
Structure Determination: Susanne L. Huthb.
Sample kindly provided by Maybridgea
University of Southamptonb
C9H10N2
InChI=1/C9H10N2/c1-11-5-4-7-6-8(10)2-3-9(7)11/h2-6H,10H2,1H3
| Identification Number: | 10.5258/ecrystals/376 |
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| Date Created: | 30 September 2007 |
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| Deposited On: | 31 Jan 2008 13:07 |
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| Deposited By: | Mrs L. Susanne Coles (née) Huth |
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Depositor Comments
More information about this compound can be found at:
http://www.maybridge.com/
Data collection parameters
| Chemical formula | C9 H10 N2 |
| Crystal morphology | Block |
| Crystal system | Orthorhombic |
| Space group symbol | Pna2(1) |
| Cell length a | 9.8821(4) |
| Cell length b | 10.9251(5) |
| Cell length c | 7.1627(3) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 90.00 |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0447 |
| R Factor (Obs) | 0.0371 |
| R Factor (All) | 0.0414 |
| Weighted R Factor (Obs) | 0.0982 |
| Weighted R Factor (All) | 0.1028 |
Citation: Sample, Donated and Huth, Susanne L. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/376)
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