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Information card for entry 1556332
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Coordinates | 1556332.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Compound 13 |
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Formula | C42 H52 Cl2 N4 O3 V |
Calculated formula | C42 H52 Cl2 N4 O3 V |
SMILES | [V](Oc1c(cccc1)/C=[NH+]/c1c(cccc1C(C)C)C(C)C)(Oc1c(cccc1)/C=[NH+]/c1c(cccc1C(C)C)C(C)C)(Cl)(Cl)=O.N#CC.N#CC |
Title of publication | Vanadium(iii) phenoxyimine complexes for ethylene or ε-caprolactone polymerization: mononuclear versus binuclear pre-catalysts |
Authors of publication | Clowes, Lucy; Walton, Mark; Redshaw, Carl; Chao, Yimin; Walton, Alex; Elo, Pertti; Sumerin, Victor; Hughes, David L. |
Journal of publication | Catal. Sci. Technol. |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 1 |
Pages of publication | 152 |
a | 11.0873 ± 0.0005 Å |
b | 17.9157 ± 0.0008 Å |
c | 20.6832 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4108.4 ± 0.4 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P 21 n b |
Hall space group symbol | P -2bc 2a |
Residual factor for all reflections | 0.0776 |
Residual factor for significantly intense reflections | 0.0505 |
Weighted residual factors for significantly intense reflections | 0.0899 |
Weighted residual factors for all reflections included in the refinement | 0.0978 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 0.71075 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/1556332.html
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