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Information card for entry 4065368
Preview
Coordinates | 4065368.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H49 Cl8 Cr2 N2 O4 |
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Calculated formula | C50 H49 Cl8 Cr2 N2 O4 |
SMILES | C12c3cccc4c3c(ccc4)[C@@]31[C@]14C(c5cccc6c5c1ccc6)=[N](c1c(cccc1C)C)[Cr]1([Cl][Cr](Cl)([N]=2c2c(cccc2C)C)([O]31)(O4)[O]1CCCC1)(Cl)(Cl)[O]1CCCC1.C(Cl)Cl.C(Cl)Cl.C12c3cccc4c3c(ccc4)[C@]31[C@@]14C(c5cccc6c5c1ccc6)=[N](c1c(cccc1C)C)[Cr]1([Cl][Cr](Cl)([N]=2c2c(cccc2C)C)([O]31)(O4)[O]1CCCC1)(Cl)(Cl)[O]1CCCC1.C(Cl)Cl.C(Cl)Cl |
Title of publication | Chromium Complexes with Acenaphthene Imine Derivative Ligands Synthesis and Catalysis on Diene Polymerization |
Authors of publication | Gao, Bo; Gao, Wei; Wu, Qiaolin; Luo, Xuyang; Zhang, Jingshun; Su, Qing; Mu, Ying |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 20 |
Pages of publication | 5480 |
a | 12.098 ± 0.0005 Å |
b | 13.5994 ± 0.0006 Å |
c | 15.5225 ± 0.0007 Å |
α | 98.197 ± 0.001° |
β | 99.215 ± 0.001° |
γ | 97.544 ± 0.001° |
Cell volume | 2463.89 ± 0.19 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1163 |
Residual factor for significantly intense reflections | 0.0915 |
Weighted residual factors for significantly intense reflections | 0.236 |
Weighted residual factors for all reflections included in the refinement | 0.2603 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
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/4065368.html
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structural data.