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Information card for entry 4131251
Preview
Coordinates | 4131251.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H22 Cl2 N4 Ni O8 S2 |
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Calculated formula | C18 H22 Cl2 N4 Ni O8 S2 |
SMILES | [Ni]123([S](Cc4[n]2cccc4)CC[S]1Cc1[n]3cccc1)([N]#CC)[N]#CC.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-] |
Title of publication | Visible-Light-Driven Photocatalytic CO<sub>2</sub> Reduction by a Ni(II) Complex Bearing a Bioinspired Tetradentate Ligand for Selective CO Production. |
Authors of publication | Hong, Dachao; Tsukakoshi, Yuto; Kotani, Hiroaki; Ishizuka, Tomoya; Kojima, Takahiko |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2017 |
Journal volume | 139 |
Journal issue | 19 |
Pages of publication | 6538 - 6541 |
a | 14.414 ± 0.005 Å |
b | 11.965 ± 0.005 Å |
c | 32.171 ± 0.005 Å |
α | 90 ± 0.005° |
β | 101.231 ± 0.005° |
γ | 90 ± 0.005° |
Cell volume | 5442 ± 3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0935 |
Residual factor for significantly intense reflections | 0.0678 |
Weighted residual factors for significantly intense reflections | 0.1835 |
Weighted residual factors for all reflections included in the refinement | 0.1959 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
Diffraction radiation wavelength | 0.71069 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/4131251.html
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