Sample Originator: Samantha K Calleara and Michael B. Hursthousea.
Data Collection: Samantha K Calleara
Structure Determination: Samantha K Calleara.
University of Southamptona
C10H20N2O6
InChI=1/C4H10NO.CH2O2/c1-3-6-4-2-5-1;2-1-3/h1-5H2;1H,(H,2,3)
| Identification Number: | 10.5258/ecrystals/440 |
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| Date Created: | 29 May 2008 |
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| Deposited On: | 29 May 2008 11:59 |
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| Deposited By: | Dr Samantha K Callear |
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Data collection parameters
| Chemical formula | C10 H20 N2 O6 |
| Crystal morphology | Block |
| Crystal system | Monoclinic |
| Space group symbol | P21/c |
| Cell length a | 9.6872(5) |
| Cell length b | 6.5461(3) |
| Cell length c | 10.8209(5) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 102.698(3) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0519 |
| R Factor (Obs) | 0.0280 |
| R Factor (All) | 0.0332 |
| Weighted R Factor (Obs) | 0.0683 |
| Weighted R Factor (All) | 0.0714 |
Citation: Callear, Samantha K and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/440)
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