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Information card for entry 7003553
Preview
Coordinates | 7003553.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H48 Bi2 N4 O3 |
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Calculated formula | C37 H48 Bi2 N4 O3 |
SMILES | [Bi]1(c2c(cccc2)C[N]1(C)C)(c1c(cccc1)CN(C)C)OC(=O)O[Bi]1(c2c(cccc2)C[N]1(C)C)c1c(cccc1)CN(C)C |
Title of publication | Hypervalent organobismuth(iii) carbonate, chalcogenides and halides with the pendant arm ligands 2-(Me2NCH2)C6H4 and 2,6-(Me2NCH2)2C6H3 |
Authors of publication | Breunig, Hans J.; Königsmann, Lucia; Lork, Enno; Nema, Mihai; Philipp, Nicky; Silvestru, Cristian; Soran, Albert; Varga, Richard A.; Wagner, Roxana |
Journal of publication | Dalton Transactions |
Year of publication | 2008 |
Journal issue | 14 |
Pages of publication | 1831 - 1842 |
a | 17.063 ± 0.007 Å |
b | 9.502 ± 0.004 Å |
c | 24.891 ± 0.01 Å |
α | 90° |
β | 106.916 ± 0.007° |
γ | 90° |
Cell volume | 3861 ± 3 Å3 |
Cell temperature | 297 ± 2 K |
Ambient diffraction temperature | 297 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0573 |
Residual factor for significantly intense reflections | 0.0502 |
Weighted residual factors for significantly intense reflections | 0.0945 |
Weighted residual factors for all reflections included in the refinement | 0.097 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.229 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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