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Information card for entry 4079171
Preview
Coordinates | 4079171.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H40 Hf N2 |
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Calculated formula | C40 H40 Hf N2 |
SMILES | [Hf]1(N(c2cccc3c2[n]1c(cc3C)C)c1c(cccc1C)C)(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1 |
Title of publication | Hafnium Amidoquinoline Complexes: Highly Active Olefin Polymerization Catalysts with Ultrahigh Molecular Weight Capacity |
Authors of publication | Fontaine, Philip P.; Klosin, Jerzy; McDougal, Nolan T. |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 17 |
Pages of publication | 6244 |
a | 10.6348 ± 0.0008 Å |
b | 13.7845 ± 0.001 Å |
c | 22.0152 ± 0.0016 Å |
α | 90° |
β | 96.368 ± 0.001° |
γ | 90° |
Cell volume | 3207.4 ± 0.4 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0501 |
Residual factor for significantly intense reflections | 0.0339 |
Weighted residual factors for significantly intense reflections | 0.0638 |
Weighted residual factors for all reflections included in the refinement | 0.0709 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4079171.html
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Users of the data should acknowledge the original authors of the
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