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Information card for entry 4082118
Preview
Coordinates | 4082118.cif |
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Original paper (by DOI) | HTML |
Formula | C43 H42 N P Zr |
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Calculated formula | C43 H42 N P Zr |
SMILES | [Zr]1(N2C(CCc3cccc([P]1(c1ccccc1)c1ccccc1)c23)C)(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1 |
Title of publication | Preparation of Phosphine-Amido Hafnium and Zirconium Complexes for Olefin Polymerization |
Authors of publication | Jun, Sung Hae; Park, Ji Hae; Lee, Chun Sun; Park, Seong Yeon; Go, Min Jeong; Lee, Junseong; Lee, Bun Yeoul |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 24 |
Pages of publication | 7357 |
a | 15.0515 ± 0.0004 Å |
b | 13.2544 ± 0.0004 Å |
c | 19.1998 ± 0.0005 Å |
α | 90° |
β | 107.255 ± 0.002° |
γ | 90° |
Cell volume | 3657.95 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0481 |
Residual factor for significantly intense reflections | 0.0341 |
Weighted residual factors for significantly intense reflections | 0.0743 |
Weighted residual factors for all reflections included in the refinement | 0.0852 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
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/4082118.html
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