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Information card for entry 4322414
Preview
| Coordinates | 4322414.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C37 H50 N4 O2 Ru Si4 Ti |
|---|---|
| Calculated formula | C37 H50 N4 O2 Ru Si4 Ti |
| SMILES | [Ru]1234(C5[Ti]67(N([Si]([Si]([Si](N6c6ccc(cc6)C)(C)C)([Si](N7c6ccc(cc6)C)(C)C)C)(C)C)c6ccc(cc6)C)[N]=5C)(C#[O])(C#[O])[cH]5[cH]4[cH]3[cH]2[cH]15 |
| Title of publication | Synthesis and Reactivity of Early-Late Heterodinuclear Complexes Stabilized by a Trisilylsilane-Based Tripodal Amido Ligand |
| Authors of publication | Lutz H. Gade; Martin Schubart; Bernd Findeis; Sylvie Fabre; Izoldi Bezougli; Matthias Lutz; Ian J. Scowen; Mary McPartlin |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 1999 |
| Journal volume | 38 |
| Pages of publication | 5282 - 5294 |
| a | 10.815 ± 0.002 Å |
| b | 37.894 ± 0.009 Å |
| c | 20.798 ± 0.004 Å |
| α | 90° |
| β | 100.554 ± 0.014° |
| γ | 90° |
| Cell volume | 8379 ± 3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.123 |
| Residual factor for significantly intense reflections | 0.0586 |
| Weighted residual factors for significantly intense reflections | 0.1212 |
| Weighted residual factors for all reflections included in the refinement | 0.1606 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179327 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/24. |
4322414.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4322414.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4322414.cif |
| 20686 | 2011-06-12 | ../uploads/cif-deposit/cod/cif Adding structures of 4322414 via cif-deposit CGI script. |
4322414.cif |
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Users of the data should acknowledge the original authors of the
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