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Information card for entry 2238275
Preview
Coordinates | 2238275.cif |
---|---|
Structure factors | 2238275.hkl |
Original IUCr paper | HTML |
Chemical name | Chlorido{1-[(dimethylamino)methyl]ferrocenyl-κ^2^<i>C</i>^1^,<i>N</i>}(triphenylstibine-κ<i>Sb</i>)palladium(II) |
---|---|
Formula | C31 H31 Cl Fe N Pd Sb |
Calculated formula | C31 H31 Cl Fe N Pd Sb |
SMILES | [Sb]([Pd]1(Cl)[N](C[c]23[cH]4[Fe]56789%102([c]13[cH]6[cH]45)[cH]1[cH]%10[cH]9[cH]8[cH]71)(C)C)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Chlorido{1-[(dimethylamino)methyl]ferrocenyl-κ^2^<i>C</i>^2^,<i>N</i>}(triphenylstibine-κ<i>Sb</i>)palladium(II) |
Authors of publication | Pérez, Diego; Sharma, Pankaj; Sharma, Manju; Hernández, Simón |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 7 |
Pages of publication | m372 |
a | 10.3138 ± 0.0006 Å |
b | 19.8865 ± 0.0012 Å |
c | 13.7584 ± 0.0009 Å |
α | 90° |
β | 92.984 ± 0.001° |
γ | 90° |
Cell volume | 2818.1 ± 0.3 Å3 |
Cell temperature | 291 ± 2 K |
Ambient diffraction temperature | 291 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0434 |
Residual factor for significantly intense reflections | 0.0321 |
Weighted residual factors for significantly intense reflections | 0.0602 |
Weighted residual factors for all reflections included in the refinement | 0.0625 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.934 |
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/2238275.html
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Users of the data should acknowledge the original authors of the
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