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Information card for entry 4340662
Preview
Coordinates | 4340662.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H40 Cl2 P2 Pd |
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Calculated formula | C26 H40 Cl2 P2 Pd |
SMILES | [Pd]1([P](c2c(CCc3ccccc3[P]1(C(C)C)C(C)C)cccc2)(C(C)C)C(C)C)(Cl)Cl |
Title of publication | Flexible Coordination of Diphosphine Ligands Leading to cis and trans Pd(0), Pd(II), and Rh(I) Complexes. |
Authors of publication | Comanescu, Cezar C.; Iluc, Vlad M. |
Journal of publication | Inorganic chemistry |
Year of publication | 2014 |
Journal volume | 53 |
Journal issue | 16 |
Pages of publication | 8517 - 8528 |
a | 9.472 ± 0.0007 Å |
b | 13.5331 ± 0.0011 Å |
c | 20.7908 ± 0.0018 Å |
α | 90° |
β | 94.265 ± 0.002° |
γ | 90° |
Cell volume | 2657.7 ± 0.4 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 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 | 0.0321 |
Residual factor for significantly intense reflections | 0.0231 |
Weighted residual factors for significantly intense reflections | 0.0484 |
Weighted residual factors for all reflections included in the refinement | 0.0504 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4340662.html
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