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Information card for entry 4519153
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Coordinates | 4519153.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H36 B10 O |
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Calculated formula | C31 H36 B10 O |
Title of publication | Variable Metal Chelation Modes and Activation Sequence in Pd-Catalyzed B–H Poly-arylation of Carboranes |
Authors of publication | Cao, Hou-ji; Chen, Meng; Sun, Fangxiang; Zhao, Yue; Lu, Changsheng; Zhang, Xiaolei; Shi, Zhuangzhi; Yan, Hong |
Journal of publication | ACS Catalysis |
Year of publication | 2021 |
Journal volume | 11 |
Journal issue | 22 |
Pages of publication | 14047 - 14057 |
a | 24.4616 ± 0.0012 Å |
b | 13.4493 ± 0.0006 Å |
c | 18.7508 ± 0.0008 Å |
α | 90° |
β | 100.232 ± 0.002° |
γ | 90° |
Cell volume | 6070.7 ± 0.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 4 |
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 | 0.17 |
Residual factor for significantly intense reflections | 0.1041 |
Weighted residual factors for significantly intense reflections | 0.2454 |
Weighted residual factors for all reflections included in the refinement | 0.2852 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4519153.html
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structural data.