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Information card for entry 4063238
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4063238.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H40 Mn Mo2 O4 P |
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Calculated formula | C32 H40 Mn Mo2 O4 P |
SMILES | C([Mo]123456([Mo]789%10(C#[O])([H]1[Mn]%13%14%11%12(C#[O])(C#[O])[c]1([cH]%11[cH]%12[cH]%14[cH]%131)C)([P]2(C1CCCCC1)C1CCCCC1)[cH]1[cH]8[cH]9[cH]%10[cH]17)[cH]1[cH]3[cH]4[cH]5[cH]61)#[O] |
Title of publication | Reactivity of the Unsaturated Hydride [Mo2(5η-C5H5)2(μ-H)(μ-PCy2)(CO)2] toward 17- and 16-Electron Metal Carbonyl Fragments: Rational Synthesis of Electron-Deficient Heterometallic Clusters |
Authors of publication | Celedonio M. Alvarez; M. Angeles Alvarez; M. Esther García; Alberto Ramos; Miguel A. Ruiz; Claudia Graiff; Antonio Tiripicchio |
Journal of publication | Organometallics |
Year of publication | 2007 |
Journal volume | 26 |
Pages of publication | 321 - 331 |
a | 9.9059 ± 0.0018 Å |
b | 22.193 ± 0.004 Å |
c | 13.832 ± 0.002 Å |
α | 90° |
β | 100.521 ± 0.003° |
γ | 90° |
Cell volume | 2989.7 ± 0.9 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0886 |
Residual factor for significantly intense reflections | 0.0444 |
Weighted residual factors for significantly intense reflections | 0.0644 |
Weighted residual factors for all reflections included in the refinement | 0.0776 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.115 |
Diffraction radiation probe | x-ray |
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/4063238.html
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Users of the data should acknowledge the original authors of the
structural data.