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Information card for entry 7716205
Preview
Coordinates | 7716205.cif |
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Original paper (by DOI) | HTML |
Formula | C10 H22 O4 Ru S6 |
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Calculated formula | C10 H22 O4 Ru S6 |
SMILES | [Ru]12([S]=C(S1)OCC)([S](=O)(C)C)([S]=C(S2)OCC)[S](=O)(C)C |
Title of publication | Development of ruthenium complexes with S-donor ligands for application in synthesis, catalytic acceptorless alcohol dehydrogenation and crossed-aldol condensation. |
Authors of publication | Chandra, Anushri; Basu, Pousali; Raha, Shreya; Dhibar, Papu; Bhattacharya, Samaresh |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2024 |
Journal volume | 53 |
Journal issue | 25 |
Pages of publication | 10675 - 10685 |
a | 11.6867 ± 0.0016 Å |
b | 11.6375 ± 0.0016 Å |
c | 29.571 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4021.8 ± 1 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0479 |
Residual factor for significantly intense reflections | 0.0385 |
Weighted residual factors for significantly intense reflections | 0.1351 |
Weighted residual factors for all reflections included in the refinement | 0.1444 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.155 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
293081 (current) | 2024-07-05 | cif/ Updating files of 7716201, 7716202, 7716203, 7716204, 7716205, 7716206 Original log message: Adding full bibliography for 7716201--7716206.cif. |
7716205.cif |
292105 | 2024-05-30 | cif/ Adding structures of 7716201, 7716202, 7716203, 7716204, 7716205, 7716206 via cif-deposit CGI script. |
7716205.cif |
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Users of the data should acknowledge the original authors of the
structural data.