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Information card for entry 4342006
Preview
| Coordinates | 4342006.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C47 H41 F12 N3 Ni S2 |
|---|---|
| Calculated formula | C47 H41 F12 N3 Ni S2 |
| Title of publication | Electrocatalytic Proton Reduction by Dimeric Nickel Complex of a Sterically Demanding Pincer-type NS2 Aminobis(thiophenolate) Ligand. |
| Authors of publication | Mondragón, Alexander; Flores-Alamo, Marcos; Martínez-Alanis, Paulina R; Aullón, Gabriel; Ugalde-Saldívar, Víctor M; Castillo, Ivan |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 2 |
| Pages of publication | 619 - 627 |
| a | 9.6517 ± 0.0009 Å |
| b | 15.0585 ± 0.0012 Å |
| c | 16.2831 ± 0.0015 Å |
| α | 76.671 ± 0.007° |
| β | 86.448 ± 0.008° |
| γ | 79.009 ± 0.007° |
| Cell volume | 2260.2 ± 0.4 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 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 | 0.1167 |
| Residual factor for significantly intense reflections | 0.0703 |
| Weighted residual factors for significantly intense reflections | 0.1546 |
| Weighted residual factors for all reflections included in the refinement | 0.1901 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179523 (current) | 2016-03-24 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/20. |
4342006.cif |
| 130493 | 2015-02-04 | cif/ Updating files of 4342003, 4342004, 4342005, 4342006, 4342007 Original log message: Adding full bibliography for 4342003--4342007.cif. |
4342006.cif |
| 129153 | 2014-12-30 | cif/ Adding structures of 4342003, 4342004, 4342005, 4342006, 4342007 via cif-deposit CGI script. |
4342006.cif |
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Users of the data should acknowledge the original authors of the
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