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Information card for entry 7049146
Preview
Coordinates | 7049146.cif |
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Original paper (by DOI) | HTML |
Formula | C39 H64 Al B N4 |
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Calculated formula | C39 H64 Al B N4 |
Title of publication | Reversible borohydride formation from aluminium hydrides and {H(9-BBN)}<sub>2</sub>: structural, thermodynamic and reactivity studies. |
Authors of publication | Caise, Alexa; Kolychev, Eugene L.; Hicks, Jamie; Fuentes, M Ángeles; Goicoechea, Jose M.; Aldridge, Simon |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2019 |
Journal volume | 48 |
Journal issue | 29 |
Pages of publication | 10845 - 10852 |
a | 9.0194 ± 0.0001 Å |
b | 21.1266 ± 0.0003 Å |
c | 10.7665 ± 0.0002 Å |
α | 90° |
β | 113.865 ± 0.002° |
γ | 90° |
Cell volume | 1876.14 ± 0.06 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 11 |
Hermann-Mauguin space group symbol | P 1 21/m 1 |
Hall space group symbol | -P 2yb |
Residual factor for all reflections | 0.04 |
Residual factor for significantly intense reflections | 0.0371 |
Weighted residual factors for significantly intense reflections | 0.0934 |
Weighted residual factors for all reflections included in the refinement | 0.0963 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7049146.html
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