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Information card for entry 4071305
Preview
| Coordinates | 4071305.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H83 Cl N2 O3 V |
|---|---|
| Calculated formula | C54 H76 Cl N2 O2 V |
| SMILES | [N]1([V]2(Oc3c(cc(cc3C(C)(C)C)C(C)(C)C)C=1)(Cl)[N](=Cc1c(O2)c(cc(c1)C(C)(C)C)C(C)(C)C)c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C |
| Title of publication | Synthesis, Structural Characterization, and Ethylene Polymerization Behavior of the Vanadium(III) Complexes Bearing Salicylaldiminato Ligands |
| Authors of publication | Wu, Ji-Qian; Pan, Li; Hu, Ning-Hai; Li, Yue-Sheng |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 15 |
| Pages of publication | 3840 |
| a | 17.673 ± 0.003 Å |
| b | 27.429 ± 0.005 Å |
| c | 11.828 ± 0.0019 Å |
| α | 90° |
| β | 93.019 ± 0.004° |
| γ | 90° |
| Cell volume | 5725.7 ± 1.7 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.2364 |
| Residual factor for significantly intense reflections | 0.1185 |
| Weighted residual factors for significantly intense reflections | 0.3157 |
| Weighted residual factors for all reflections included in the refinement | 0.3802 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.995 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178602 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/13. |
4071305.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4071305.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071305.cif |
| 43142 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4071297, 4071298, 4071299, 4071300, 4071301, 4071302, 4071303, 4071304, 4071305, 4071306 via cif-deposit CGI script. |
4071305.cif |
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Users of the data should acknowledge the original authors of the
structural data.