Sample Originator: Peter J. Hollimana.
Data Collection: Samantha K. Callearb and Michael B. Hursthouseb
Structure Determination: Samantha K. Callearb.
University of Wales, Bangora
University of Southamptonb
C12H16N2O2
InChI=1/C12H16N2O2/c1-8(2)9(3)13-14-11-6-4-10(5-7-11)12(15)16/h4-8,14H,1-3H3,(H,15,16)/b13-9+
| Identification Number: | 10.5258/ecrystals/713 |
|---|
| Date Created: | 19 May 2009 |
|---|
| Deposited On: | 15 Nov 2009 18:30 |
|---|
| Deposited By: | Dr Samantha K Callear |
|---|
Data collection parameters
| Chemical formula | C12 H16 N2 O2 |
| Crystal morphology | Plate |
| Crystal system | monoclinic |
| Space group symbol | P21/c |
| Cell length a | 19.9190(15) |
| Cell length b | 4.7488(4) |
| Cell length c | 12.3797(11) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 95.736(5) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0875 |
| R Factor (All) | 0.1331 |
| Weighted R Factor (Obs) | 0.1486 |
| Weighted R Factor (All) | 0.1707 |
Citation: Holliman, Peter J. and Callear, Samantha K. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/713)
Export as: oreChem EndNote BibTeX ASCII Citation
