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Information card for entry 4078334
Preview
Coordinates | 4078334.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H18 Cl2 Mo2 O12 Ru4 |
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Calculated formula | C27 H18 Cl2 Mo2 O12 Ru4 |
SMILES | [Ru]1234([Ru]56([Ru]71([Ru]185([Mo]59%10%11%12%1326([Mo]26%14%15371(C85C)(C49C)[cH]1[cH]%15[cH]%14[cH]6[cH]21)[cH]1[cH]%10[cH]%11[cH]%12[cH]%131)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O].ClCCl |
Title of publication | Rearrangement and Scission of Terminal Alkynes in Dimolybdenum Complexes on Reaction with Ruthenium Carbonyl: Formation of Trinuclear Vinylidene and Hexanuclear Bis(alkylidyne) Clusters |
Authors of publication | Adams, Harry; Gill, Louise J.; Morris, Michael J. |
Journal of publication | Organometallics |
Year of publication | 1996 |
Journal volume | 15 |
Journal issue | 20 |
Pages of publication | 4182 |
a | 15.126 ± 0.003 Å |
b | 14.672 ± 0.002 Å |
c | 15.196 ± 0.002 Å |
α | 90° |
β | 91.81 ± 0.01° |
γ | 90° |
Cell volume | 3370.7 ± 0.9 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/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0436 |
Residual factor for significantly intense reflections | 0.0384 |
Weighted residual factors for all reflections | 0.1018 |
Weighted residual factors for significantly intense reflections | 0.0985 |
Goodness-of-fit parameter for all reflections | 1.224 |
Goodness-of-fit parameter for significantly intense reflections | 1.262 |
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/4078334.html
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Users of the data should acknowledge the original authors of the
structural data.