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Information card for entry 1547495
Preview
Coordinates | 1547495.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C56 H48 Cl2 N2 Ni |
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Calculated formula | C56 H48 Cl2 N2 Ni |
SMILES | [Ni]1(Cl)(Cl)[N](=C2C(=[N]1c1c(C(c3ccccc3)c3ccccc3)cc(cc1C(c1ccccc1)c1ccccc1)C(C)(C)C)c1c3c2cccc3ccc1)c1c(cccc1C)C |
Title of publication | Ultra-high molecular weight elastomeric polyethylene using an electronically and sterically enhanced nickel catalyst |
Authors of publication | Mahmood, Qaiser; Zemg, Yanning; Yue, Erlin; Solan, Gregory; Liang, Tongling; Sun, Wen Hua |
Journal of publication | Polym. Chem. |
Year of publication | 2017 |
a | 29.579 ± 0.004 Å |
b | 29.579 ± 0.004 Å |
c | 32.113 ± 0.006 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 24332 ± 7 Å3 |
Cell temperature | 173.15 K |
Ambient diffraction temperature | 173.15 K |
Number of distinct elements | 5 |
Space group number | 148 |
Hermann-Mauguin space group symbol | R -3 |
Hall space group symbol | -R 3 |
Residual factor for all reflections | 0.1011 |
Residual factor for significantly intense reflections | 0.0868 |
Weighted residual factors for significantly intense reflections | 0.2477 |
Weighted residual factors for all reflections included in the refinement | 0.2621 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
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/1547495.html
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