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Information card for entry 4314677
Preview
Coordinates | 4314677.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H47 Cl N6 Ni O6 |
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Calculated formula | C33 H47 Cl N6 Ni O6 |
Title of publication | O2-Dependent Aliphatic Carbon-Carbon Bond Cleavage Reactivity in a Ni(II) Enolate Complex Having a Hydrogen Bond Donor Microenvironment; Comparison with a Hydrophobic Analogue |
Authors of publication | Katarzyna Grubel; Amy L. Fuller; Bonnie M. Chambers; Atta M. Arif; Lisa M. Berreau |
Journal of publication | Inorganic Chemistry |
Year of publication | 2010 |
Journal volume | 49 |
Pages of publication | 1071 - 1081 |
a | 8.981 ± 0.0002 Å |
b | 10.9647 ± 0.0002 Å |
c | 18.2657 ± 0.0004 Å |
α | 102.655 ± 0.0012° |
β | 96.3498 ± 0.0011° |
γ | 93.1764 ± 0.0013° |
Cell volume | 1738.34 ± 0.06 Å3 |
Cell temperature | 150 ± 1 K |
Ambient diffraction temperature | 150 ± 1 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 | 0.0597 |
Residual factor for significantly intense reflections | 0.0491 |
Weighted residual factors for significantly intense reflections | 0.1289 |
Weighted residual factors for all reflections included in the refinement | 0.1385 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
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/4314677.html
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Users of the data should acknowledge the original authors of the
structural data.