01SRC912 (578) - C20H30Cl2FeN6O8
Sample Originator: Ian A. Fallisa. Data Collection: Mark E. Lightb and Michael B. Hursthouseb Structure Determination: Mark E. Lightb. Cardiff Universitya University of Southamptonb
C20H30Cl2FeN6O8 InChI=1/C10H17N3.ClHO.Fe.3H2O/c1-12-7-8-13(2)10-6-4-3-5-9(10)11;1-2;;;;/h3-6,12H,7-8,11H2,1-2H3;2H;;3*1H2 Date Created: | 02 November 2001 |
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Deposited On: | 23 Dec 2014 13:07 |
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Deposited By: | Mr Steve Lamond |
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Data collection parametersChemical formula | C20 H30 Cl2 Fe N6 O8 | Crystal morphology | | Crystal system | Monoclinic | Space group symbol | C2/c | Cell length a | 19.0961(8) | Cell length b | 8.5356(5) | Cell length c | 16.7145(7) | Cell angle alpha | 90.00 | Cell angle beta | 115.869(4) | Cell angle gamma | 90.00 | Data collection temperature | 120(2) |
Refinement resultsSolution figure of merit | | R Factor (Obs) | 0.0468 | R Factor (All) | 0.0601 | Weighted R Factor (Obs) | 0.1104 | Weighted R Factor (All) | 0.1170 |
Citation: Fallis, Ian A. and Light, Mark E. and Hursthouse, Michael B. (2001) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/726/) Export as: oreChem EndNote BibTeX ASCII Citation Available FilesFinal ResultValidationRefinementProcessingOther Files Repository Staff Only: item control page
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