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Information card for entry 2235667
Preview
Coordinates | 2235667.cif |
---|---|
Structure factors | 2235667.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[tricarbonyl-1κ^3^<i>C</i>-(1η^5^- cyclopentadienyl)lead(II)molybdenum(0)](<i>Mo</i>—<i>Pb</i>)-μ~3~-acetato- 2':2:2''κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'] |
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Formula | C10 H8 Mo O5 Pb |
Calculated formula | C10 H8 Mo O5 Pb |
SMILES | C1(C)=[O][Pb]O1.[Mo]1234(C#[O])(C#[O])(C#[O])[cH]5[cH]2[cH]3[cH]4[cH]15 |
Title of publication | <i>catena</i>-Poly[[tricarbonyl-1κ^3^<i>C</i>-(1η^5^-cyclopentadienyl)lead(II)molybdenum(0)](<i>Mo</i>—<i>Pb</i>)-μ~3~-acetato-2':2:2''κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'] |
Authors of publication | Gerdes, Eberhard; Merzweiler, Kurt |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 7 |
Pages of publication | m869 |
a | 7.4813 ± 0.0006 Å |
b | 14.9431 ± 0.0012 Å |
c | 11.3323 ± 0.0009 Å |
α | 90° |
β | 98.66 ± 0.009° |
γ | 90° |
Cell volume | 1252.44 ± 0.18 Å3 |
Cell temperature | 220 ± 2 K |
Ambient diffraction temperature | 220 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0303 |
Residual factor for significantly intense reflections | 0.0242 |
Weighted residual factors for significantly intense reflections | 0.0548 |
Weighted residual factors for all reflections included in the refinement | 0.0562 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2235667.html
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Users of the data should acknowledge the original authors of the
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