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Information card for entry 7713647
Preview
Coordinates | 7713647.cif |
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Original paper (by DOI) | HTML |
Formula | C48 H61 N2 O7 Sb |
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Calculated formula | C48 H61 N2 O7 Sb |
SMILES | [Sb](O)(c1c(C(C)C)cccc1C(C)C)(c1c(cccc1C(C)C)C(C)C)c1c(C(C)C)cccc1C(C)C.[O-]c1ccc(N(=O)=O)cc1.Oc1ccc(N(=O)=O)cc1 |
Title of publication | Variation in pnictogen-oxygen bonding unlocks greatly enhanced Brønsted basicity for the monomeric stibine oxide. |
Authors of publication | Wenger, John S.; Getahun, Addis; Johnstone, Timothy C. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2023 |
a | 15.7304 ± 0.0003 Å |
b | 18.484 ± 0.0003 Å |
c | 15.761 ± 0.0003 Å |
α | 90° |
β | 101.383 ± 0.002° |
γ | 90° |
Cell volume | 4492.54 ± 0.14 Å3 |
Cell temperature | 100 ± 0.13 K |
Ambient diffraction temperature | 100 ± 0.13 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0362 |
Residual factor for significantly intense reflections | 0.0255 |
Weighted residual factors for significantly intense reflections | 0.0471 |
Weighted residual factors for all reflections included in the refinement | 0.0496 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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