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Information card for entry 7133027
Preview
Coordinates | 7133027.cif |
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Original paper (by DOI) | HTML |
Formula | C69 H75 B N4 O2 Si |
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Calculated formula | C69 H75 B N4 O2 Si |
SMILES | [Si]12(OC3(c4ccccc4c4c3cccc4)C3(O1)c1ccccc1c1c3cccc1)([N](=C(N2C(C)(C)C)c1ccccc1)C(C)(C)C)C#CB1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C |
Title of publication | Synthetic, structural and reactivity studies of a boryl-ethynyl Silylene. |
Authors of publication | Chen, Wenhao; Hu, Haisheng; Feng, Jie; Zhu, Lei; Wu, Di |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 45 |
Pages of publication | 5828 - 5831 |
a | 11.765 ± 0.0003 Å |
b | 23.8074 ± 0.0005 Å |
c | 23.7692 ± 0.0006 Å |
α | 90° |
β | 97.721 ± 0.001° |
γ | 90° |
Cell volume | 6597.3 ± 0.3 Å3 |
Cell temperature | 170 ± 2 K |
Ambient diffraction temperature | 170 K |
Number of distinct elements | 6 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0573 |
Residual factor for significantly intense reflections | 0.0443 |
Weighted residual factors for significantly intense reflections | 0.1072 |
Weighted residual factors for all reflections included in the refinement | 0.1158 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7133027.html
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