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Information card for entry 4519156
Preview
Coordinates | 4519156.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C90 H110 B20 N2 O4 |
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Calculated formula | C90 H110 B20 N2 O4 |
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 | 20.541 ± 0.003 Å |
b | 21.748 ± 0.003 Å |
c | 21.85 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 9761 ± 2 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 5 |
Space group number | 16 |
Hermann-Mauguin space group symbol | P 2 2 2 |
Hall space group symbol | P 2 2 |
Residual factor for all reflections | 0.1428 |
Residual factor for significantly intense reflections | 0.0683 |
Weighted residual factors for significantly intense reflections | 0.1512 |
Weighted residual factors for all reflections included in the refinement | 0.1897 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.957 |
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/4519156.html
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