Sample Originator: Michael A. Becketta.
Data Collection: Peter N. Hortonb
Structure Determination: Peter N. Hortonb and Michael B. Hursthouseb.
University of Wales, Bangora
University of Southamptonb
(C6H15N2)+ . (H4B5O10)-
InChI=1/C6H15N2.B5H4O10/c1-7-3-5-8(2)6-4-7;6-1-10-2(7)13-5(12-1)14-3(8)11-4(9)15-5/h7H,3-6H2,1-2H3;6-9H
| Identification Number: | 10.5258/ecrystals/589 |
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| Controlled Keywords: | boron compounds, small organic salts |
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| Date Created: | 08 July 2008 |
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| Deposited On: | 14 Aug 2008 17:28 |
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| Deposited By: | Dr Peter N Horton |
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Data collection parameters
| Chemical formula | C6 H19 B5 N2 O10 |
| Crystal morphology | Cut Block |
| Crystal system | triclinic |
| Space group symbol | P-1 |
| Cell length a | 8.8129(2) |
| Cell length b | 8.8960(2) |
| Cell length c | 10.3618(2) |
| Cell angle alpha | 74.0430(10) |
| Cell angle beta | 78.8540(10) |
| Cell angle gamma | 88.9620(10) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0385 |
| R Factor (Obs) | 0.0322 |
| R Factor (All) | 0.0358 |
| Weighted R Factor (Obs) | 0.0817 |
| Weighted R Factor (All) | 0.0842 |
Citation: Beckett, Michael A. and Horton, Peter N. and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/589)
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