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Information card for entry 4514361
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Display in Jmol| Coordinates | 4514361.cif |
|---|
| Formula | C38 H36 Br2 N2 Ni |
|---|---|
| Calculated formula | C38 H36 Br2 N2 Ni |
| Title of publication | Synthesis of Polyethylenes with Controlled Branching with α-Diimine Nickel Catalysts and Revisiting Formation of Long-Chain Branching |
| Authors of publication | Pei, Lixia; Liu, Fengshou; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing |
| Journal of publication | ACS Catalysis |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 2 |
| Pages of publication | 1104 |
| a | 13.579 ± 0.002 Å |
| b | 14.443 ± 0.002 Å |
| c | 18.148 ± 0.003 Å |
| α | 90° |
| β | 109.503 ± 0.003° |
| γ | 90° |
| Cell volume | 3355 ± 0.9 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.1393 |
| Residual factor for observed reflections | 0.0966 |
| Weighted residual factors for the observed reflections | 0.2194 |
| Weighted residual factors for all reflections included in the refinement | 0.2339 |
| Goodness-of-fit parameter for observed reflections | 1.157 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 206132 (current) | 2018-02-04 | cif/ Updating files of 4514359, 4514360, 4514361 Original log message: Adding full bibliography for 4514359--4514361.cif. |
4514361.cif |
| 205133 | 2018-01-13 | cif/ Adding structures of 4514361 via cif-deposit CGI script. |
4514361.cif |
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