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Information card for entry 4324908
Preview
Coordinates | 4324908.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | ZHAO1798 |
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Formula | C16 H44 B3 N O7 |
Calculated formula | C16 H44 B3 N O7 |
SMILES | [NH4+].[BH2]12[BH2]3([BH2]1[H]3)[H]2.C1COCCOCCOCCOCCOCCO1.C1CCCO1 |
Title of publication | Ammonium Octahydrotriborate (NH4B3H8): New Synthesis, Structure, and Hydrolytic Hydrogen Release |
Authors of publication | Zhenguo Huang; Xuenian Chen; Teshome Yisgedu; Edward A. Meyers; Sheldon G. Shore; Ji-Cheng Zhao |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 3738 - 3742 |
a | 16.407 ± 0.003 Å |
b | 11.215 ± 0.002 Å |
c | 13.841 ± 0.003 Å |
α | 90° |
β | 107.76 ± 0.03° |
γ | 90° |
Cell volume | 2425.4 ± 0.9 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 c 1 |
Hall space group symbol | P -2yc |
Residual factor for all reflections | 0.0805 |
Residual factor for significantly intense reflections | 0.0476 |
Weighted residual factors for significantly intense reflections | 0.0964 |
Weighted residual factors for all reflections included in the refinement | 0.1095 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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