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Information card for entry 4072043
Preview
Coordinates | 4072043.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H76 Br4 Ni2 P4 |
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Calculated formula | C34 H76 Br4 Ni2 P4 |
SMILES | Br[Ni]1(Br)[P](CCCCC[P]([Ni](Br)(Br)[P](CCCCC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C |
Title of publication | Preparation and Reactivities of PCP-Type Pincer Complexes of Nickel. Impact of Different Ligand Skeletons and Phosphine Substituents |
Authors of publication | Castonguay, Annie; Beauchamp, André L.; Zargarian, Davit |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 21 |
Pages of publication | 5723 |
a | 23.6525 ± 0.0013 Å |
b | 14.4554 ± 0.0009 Å |
c | 27.611 ± 0.0016 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 9440.4 ± 1 Å3 |
Cell temperature | 220 ± 2 K |
Ambient diffraction temperature | 220 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0704 |
Residual factor for significantly intense reflections | 0.0615 |
Weighted residual factors for significantly intense reflections | 0.1303 |
Weighted residual factors for all reflections included in the refinement | 0.136 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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