Sample Originator: Ian R. Butlera.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb and Simon J. Colesb.
University College of North Walesa
University of Southamptonb
C16H24N2Ru
InChI=1/2C8H13N.C6H12.C2H6.C2H4.2CH5N.4CH4.2Ru.3H2/c2*1-9(2)7-8-5-3-4-6-8;1-3-5-6-4-2;4*1-2;;;;;;;;;/h3-5H,6-7H2,1-2H3;3-6,8H,7H2,1-2H3;3H,1,4-6H2,2H3;1-2H3;1-2H2;2*2H2,1H3;4*1H4;;;3*1H
| Identification Number: | 10.5258/ecrystals/1103 |
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| Date Created: | 21 March 2005 |
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| Deposited On: | 10 Jun 2013 17:05 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C16 H24 N2 Ru |
| Crystal morphology | Needle |
| Crystal system | orthorhombic |
| Space group symbol | Pbca |
| Cell length a | 7.747(9) |
| Cell length b | 15.519(18) |
| Cell length c | 25.745(8) |
| 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 | 0.0203 |
| R Factor (Obs) | 0.1089 |
| R Factor (All) | 0.2192 |
| Weighted R Factor (Obs) | 0.1905 |
| Weighted R Factor (All) | 0.2333 |
Citation: Butler, Ian R. and Horton, Peter N. and Hursthouse, Michael B. and Coles, Simon J. (2005) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1103)
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