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Information card for entry 4323717
Preview
Coordinates | 4323717.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | [(biscyclopentadienylmethane)diruthenium tetracarbonyl(/m-hydride)] [trifluoromethylsulfonate] |
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Formula | C16 H11 F3 O7 Ru2 S |
Calculated formula | C16 H11 F3 O7 Ru2 S |
SMILES | [Ru]12345([H][Ru]6789([c]%10([cH]6[cH]7[cH]8[cH]9%10)C[c]61[cH]5[cH]4[cH]3[cH]26)(C#[O])C#[O])(C#[O])C#[O].S(=O)(=O)([O-])C(F)(F)F |
Title of publication | Cyclopentadienyl Ligand Effects on Enthalpies of Protonation of the Ru-Ru Bond in Cp'2Ru2(CO)4 Complexes |
Authors of publication | Chip Nataro; Leonard M. Thomas; Robert J. Angelici |
Journal of publication | Inorganic Chemistry |
Year of publication | 1997 |
Journal volume | 36 |
Pages of publication | 6000 - 6008 |
a | 30.709 ± 0.004 Å |
b | 10.374 ± 0.001 Å |
c | 12.696 ± 0.002 Å |
α | 90° |
β | 112.62 ± 0.01° |
γ | 90° |
Cell volume | 3733.5 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.072 |
Residual factor for significantly intense reflections | 0.0383 |
Weighted residual factors for all reflections | 0.1139 |
Weighted residual factors for significantly intense reflections | 0.0984 |
Goodness-of-fit parameter for all reflections | 1.039 |
Goodness-of-fit parameter for significantly intense reflections | 1.118 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4323717.html
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