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Information card for entry 4312711
Preview
Coordinates | 4312711.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C39 H28 O7 P2 Ru3 Se2 |
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Calculated formula | C39 H28 O7 P2 Ru3 Se2 |
SMILES | [Ru]123([Ru]45([Ru]([Se]14)([Se]25)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])([P](Cc1ccccc1C[P]3(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)C#[O] |
Title of publication | Reactivity of Ph2P(Se)CH2C6H4CH2P(Se)Ph2 with [M3(CO)12] (M = Ru or Fe). Synthesis and Characterization of the New Carbene Cluster [Ru3(μ3-Se)(μ3-H)(μ2-PPh2)(CO)6(μ2-CHC6H4CH2PPh2)] |
Authors of publication | Daniele Belletti; Claudia Graiff; Chiara Massera; Alex Minarelli; Giovanni Predieri; Antonio Tiripicchio; Domenico Acquotti |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 8509 - 8518 |
a | 11.4 ± 0.004 Å |
b | 19.107 ± 0.005 Å |
c | 18.973 ± 0.003 Å |
α | 90° |
β | 102.16 ± 0.03° |
γ | 90° |
Cell volume | 4040 ± 1.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1772 |
Residual factor for significantly intense reflections | 0.0336 |
Weighted residual factors for significantly intense reflections | 0.0743 |
Weighted residual factors for all reflections included in the refinement | 0.1529 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.6 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4312711.html
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