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Information card for entry 4071296
Preview
| Coordinates | 4071296.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76 H108 N8 Ni O4 Sn4 |
|---|---|
| Calculated formula | C76 H108 N8 Ni O4 Sn4 |
| SMILES | C1COCC1.C1OCCC1.[Sn]12N(c3c(N2Cc2cccc(CN4[Sn]([Ni]51[Sn]1(N(c6c(N1CC(C)(C)C)cccc6)Cc1cccc(c1)CN1[Sn]5N(c5ccccc15)CC(C)(C)C)[O]1CCCC1)N(c1ccccc41)CC(C)(C)C)c2)cccc3)CC(C)(C)C.O1CCCC1 |
| Title of publication | Homoleptic Complexes of Bisstannylenes with Nickel(0): Synthesis, X-Ray Diffraction Studies, and119Sn NMR Investigations |
| Authors of publication | Zabula, Alexander V.; Pape, Tania; Hepp, Alexander; Hahn, F. Ekkehardt |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 12 |
| Pages of publication | 2756 |
| a | 13.673 ± 0.004 Å |
| b | 15.729 ± 0.004 Å |
| c | 18.926 ± 0.005 Å |
| α | 113.997 ± 0.005° |
| β | 90.057 ± 0.005° |
| γ | 94.065 ± 0.005° |
| Cell volume | 3707.1 ± 1.7 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 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 | 0.11 |
| Residual factor for significantly intense reflections | 0.0725 |
| Weighted residual factors for significantly intense reflections | 0.172 |
| Weighted residual factors for all reflections included in the refinement | 0.1922 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178601 (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 4/07/12. |
4071296.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4071296.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071296.cif |
| 43141 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4071296 via cif-deposit CGI script. |
4071296.cif |
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Users of the data should acknowledge the original authors of the
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