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Information card for entry 4325154
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Coordinates | 4325154.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | bis(tritertbutylphosphino-copper-phenylselenolate) |
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Chemical name | bis(μ~2~-phenylselenido)-bis(tritertbutylphosphine)-di-copper |
Formula | C36 H64 Cu2 P2 Se2 |
Calculated formula | C36 H64 Cu2 P2 Se2 |
SMILES | [Cu]12([Cu]([Se]1c1ccccc1)([Se]2c1ccccc1)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C |
Title of publication | Trialkylphosphine-Stabilized Copper(I) Phenylchalcogenolate Complexes - Crystal Structures and Copper-Chalcogenolate Bonding |
Authors of publication | Oliver Kluge; Katharina Grummt; Ralf Biedermann; Harald Krautscheid |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 4742 - 4752 |
a | 10.8035 ± 0.0005 Å |
b | 16.1997 ± 0.0008 Å |
c | 22.5376 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3944.4 ± 0.3 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0489 |
Residual factor for significantly intense reflections | 0.0358 |
Weighted residual factors for significantly intense reflections | 0.0643 |
Weighted residual factors for all reflections included in the refinement | 0.0672 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.95 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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