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Information card for entry 4064090
Preview
| Coordinates | 4064090.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H52 F3 N O3 Ru2 S |
|---|---|
| Calculated formula | C46 H52 F3 N O3 Ru2 S |
| SMILES | [Ru]12345678([Ru]9%10%11%12%13%14%15([N]1([C]%11(=[CH]%10[CH]4=[C]3(C29)c1ccc(cc1)C)c1ccc(cc1)C)c1ccccc1)[c]1([c]%12([c]%13([c]%14([c]%151C)C)C)C)C)[c]1([c]5([c]6([c]7([c]81C)C)C)C)C.S(=O)(=O)([O-])C(F)(F)F |
| Title of publication | Synthesis and Reactivity of Coordinatively Unsaturated Dinuclear Ruthenium Bridging Imido Complexes |
| Authors of publication | Takemoto, Shin; Kobayashi, Tomoharu; Ito, Takahiro; Inui, Akira; Karitani, Kenji; Katagiri, Sayuri; Masuhara, Yusaku; Matsuzaka, Hiroyuki |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 8 |
| Pages of publication | 2160 |
| a | 11.463 ± 0.003 Å |
| b | 21.894 ± 0.006 Å |
| c | 16.896 ± 0.004 Å |
| α | 90° |
| β | 90.331 ± 0.01° |
| γ | 90° |
| Cell volume | 4240.3 ± 1.9 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0879 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.133 |
| Weighted residual factors for all reflections included in the refinement | 0.1527 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275145 (current) | 2022-05-06 | cif/4/06/40/ Replaced the 'Â¥' sequences with backslash symbols ('\') in multiple data values in entries 4064086, 4064090, 4064091. |
4064090.cif |
| 178502 | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/40. |
4064090.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4064090.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4064090.cif |
| 32778 | 2012-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 4064083, 4064084, 4064085, 4064086, 4064087, 4064088, 4064089, 4064090, 4064091 via cif-deposit CGI script. |
4064090.cif |
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Users of the data should acknowledge the original authors of the
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