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Information card for entry 4063855
Preview
Coordinates | 4063855.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H40 Cl2 Hf |
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Calculated formula | C32 H40 Cl2 Hf |
SMILES | [c]12([c]3([c]45c(c(c(c([c]64[c]41CC[c]17[Hf]89%1023564(Cl)([c]1([c]%10([c]19[c]78c(c(c(c1C)C)C)C)C)C)Cl)C)C)C)C)C)C |
Title of publication | Synthesis, Characterization, and Polymerization Studies of Ethylenebis(hexamethylindenyl) Complexes of Zirconium and Hafnium |
Authors of publication | Ransom, Paul; Ashley, Andrew E.; Brown, N. David; Thompson, Amber L.; O’Hare, Dermot |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 4 |
Pages of publication | 800 |
a | 25.4431 ± 0.0003 Å |
b | 8.2319 ± 0.0002 Å |
c | 16.4078 ± 0.0003 Å |
α | 90° |
β | 129.466 ± 0.0007° |
γ | 90° |
Cell volume | 2653 ± 0.09 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0257 |
Residual factor for significantly intense reflections | 0.0239 |
Weighted residual factors for all reflections | 0.0554 |
Weighted residual factors for significantly intense reflections | 0.0545 |
Weighted residual factors for all reflections included in the refinement | 0.0554 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.9925 |
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/4063855.html
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Users of the data should acknowledge the original authors of the
structural data.