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Information card for entry 4329639
Preview
Coordinates | 4329639.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H30 N O4 V |
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Calculated formula | C24 H30 N O4 V |
SMILES | [V]12([N](Cc3c(O1)cc(c(c3)C)C)(CCC)Cc1c(O2)cc(c(c1)C)C)(=O)OC(C)C |
Title of publication | Aerobic Oxidation Reactions Catalyzed by Vanadium Complexes of Bis(Phenolate) Ligands |
Authors of publication | Guoqi Zhang; Brian L. Scott; Ruilian Wu; L. A. Pete Silks; Susan K. Hanson |
Journal of publication | Inorganic Chemistry |
Year of publication | 2012 |
Journal volume | 51 |
Pages of publication | 7354 - 7361 |
a | 18.394 ± 0.005 Å |
b | 11.734 ± 0.003 Å |
c | 21.344 ± 0.006 Å |
α | 90° |
β | 94.664 ± 0.003° |
γ | 90° |
Cell volume | 4592 ± 2 Å3 |
Cell temperature | 120 ± 1 K |
Ambient diffraction temperature | 120 ± 1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1654 |
Residual factor for significantly intense reflections | 0.0666 |
Weighted residual factors for significantly intense reflections | 0.1517 |
Weighted residual factors for all reflections included in the refinement | 0.1978 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4329639.html
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