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Information card for entry 7027681
Preview
Coordinates | 7027681.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62 H62 Cl4 O4 P4 Ru |
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Calculated formula | C62 H62 Cl4 O4 P4 Ru |
SMILES | C1(C)=CC(C)=[O][Ru]2(OC(=CC(C)=[O]2)C)(O1)([P](c1ccccc1)(c1ccccc1)C[P](c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)C[P](c1ccccc1)c1ccccc1.ClCCl.C(Cl)Cl |
Title of publication | Bis(acetylacetonato)bis(cyclooctene)ruthenium(II), cis-[Ru(acac)2(η2-C8H14)2]: a synthetic precursor to trans- and cis-bis(acetylacetonato)ruthenium(II) complexes † |
Authors of publication | Bennett, Martin A.; Chung, Guandolina; Hockless, David C. R.; Neumann, Horst; Willis, Anthony C. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 19 |
Pages of publication | 3451 |
a | 10.571 ± 0.003 Å |
b | 13.108 ± 0.004 Å |
c | 13.278 ± 0.004 Å |
α | 61.84 ± 0.02° |
β | 69.52 ± 0.02° |
γ | 85.32 ± 0.03° |
Cell volume | 1511.8 ± 0.9 Å3 |
Cell temperature | 296.2 K |
Ambient diffraction temperature | 296.2 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 | 0.069 |
Residual factor for significantly intense reflections | 0.0452 |
Weighted residual factors for all reflections | 0.0528 |
Weighted residual factors for all reflections included in the refinement | 0.0507 |
Goodness-of-fit parameter for all reflections | 2.092 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.319 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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