03SRC062
- C36H35CrN15O550
Sample Originator: Craig J. Matthewsa. Data Collection: Peter N. Hortonb and Michael B. Hursthouseb Structure Determination: Peter N. Hortonb. Nottingham Trent Universitya
University of Southamptonb
C36H35CrN15O550 InChI=1/3C12H8N5.Cr.6H2O/c3*1-3-7-13-9(5-1)11-15-12(17-16-11)10-6-2-4-8-14-10;;;;;;;/h3*1-8H;;6*1H2/q3*-1;+3;;;;;; | Identification Number: | 10.5258/ecrystals/969 |
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| Controlled Keywords: | supramolecular assemblies, chromium compounds |
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| Date Created: | 20 February 2003 |
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| Deposited On: | 14 Aug 2013 23:10 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters| Chemical formula | C36 H35 Cr N15 O5.50 | | Crystal morphology | | | Crystal system | Triclinic | | Space group symbol | P-1 | | Cell length a | 10.138(2) | | Cell length b | 11.861(2) | | Cell length c | 17.072(3) | | Cell angle alpha | 105.284(1) | | Cell angle beta | 93.568(1) | | Cell angle gamma | 110.9903(8) | | Data collection temperature | 120(2) |
Refinement results| Solution figure of merit | 0.1504 | | R Factor (Obs) | 0.0595 | | R Factor (All) | 0.0902 | | Weighted R Factor (Obs) | 0.1322 | | Weighted R Factor (All) | 0.1443 |
Citation: Matthews, Craig J. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/969)
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