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Information card for entry 8102438
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Coordinates | 8102438.cif |
---|
Chemical name | bis(π-allylvalencene)dichlorodipalladium |
---|---|
Formula | C30 H46 Cl2 Pd2 |
Calculated formula | C30 H46 Cl2 Pd2 |
SMILES | [CH2]1=[C]2(C[Pd]312[Cl][Pd]12([CH2]=[C]1(C2)[C@H]1C[C@]2([C@@H](CCC=C2CC1)C)C)[Cl]3)[C@H]1C[C@]2([C@@H](CCC=C2CC1)C)C |
Title of publication | Crystal structure of bis(p-allylvalencene)dichlorodipalladium, [PdCl(C15H23)]2 |
Authors of publication | Amine El Farrouji; Larbi El Firdoussi; Mustapha Ait Ali; Abdallah Karim; Anke Spannenberg |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2009 |
Journal volume | 224 |
Journal issue | 3 |
Pages of publication | 385 |
a | 22.0083 ± 0.0006 Å |
b | 6.1827 ± 0.0002 Å |
c | 21.5654 ± 0.0007 Å |
α | 90° |
β | 91.252 ± 0.002° |
γ | 90° |
Cell volume | 2933.72 ± 0.16 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 4 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0211 |
Residual factor for significantly intense reflections | 0.0185 |
Weighted residual factors for significantly intense reflections | 0.0385 |
Weighted residual factors for all reflections included in the refinement | 0.0387 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.92 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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