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Information card for entry 7036084
Preview
Coordinates | 7036084.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C48 H56 B4 Mn P2 |
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Calculated formula | C48 H56 B4 Mn P2 |
SMILES | [BH2]1[H][Mn]234([H]1)([H][BH2][H]2)([H][BH2][H]3)[H][BH2][H]4.c1c(cccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.c1ccccc1[P+](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Salts of highly fluorinated weakly coordinating anions as versatile precursors towards hydrogen storage materials. |
Authors of publication | Starobrat, A.; Tyszkiewicz, M. J.; Wegner, W.; Pancerz, D.; Orłowski, P A; Leszczyński, P J; Fijalkowski, K. J.; Jaroń, T; Grochala, W. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 45 |
Pages of publication | 19469 - 19477 |
a | 11.216 ± 0.003 Å |
b | 19.919 ± 0.006 Å |
c | 21.053 ± 0.006 Å |
α | 90° |
β | 91.843 ± 0.005° |
γ | 90° |
Cell volume | 4701 ± 2 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0528 |
Residual factor for significantly intense reflections | 0.0514 |
Weighted residual factors for all reflections | 0.0512 |
Weighted residual factors for significantly intense reflections | 0.0511 |
Goodness-of-fit parameter for all reflections | 1.89 |
Method of determination | powder diffraction |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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