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Information card for entry 4310972
Preview
Coordinates | 4310972.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C65 H71 B2 Cu2 F8 N3 P4 |
---|---|
Calculated formula | C65 H71 B2 Cu2 F8 N3 P4 |
SMILES | [Cu]12([P](c3ccccc3)(c3ccccc3)C[P]([Cu]([P](c3ccccc3)(c3ccccc3)C[P]1(c1ccccc1)c1ccccc1)(C#[N]C(C)(C)C)C2=NC(C)(C)C)(c1ccccc1)c1ccccc1)C#[N]C(C)(C)C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-] |
Title of publication | Preparation and Solid-State Characterization of Mixed-Ligand Coordination/Organometallic Oligomers and Polymers of Copper(I) and Silver(I) Using Diphosphine and Mono- and Diisocyanide Ligands |
Authors of publication | Éric Fournier; Frédéric Lebrun; Marc Drouin; Andreas Decken; Pierre D. Harvey |
Journal of publication | Inorganic Chemistry |
Year of publication | 2004 |
Journal volume | 43 |
Pages of publication | 3127 - 3135 |
a | 20.395 ± 0.003 Å |
b | 15.287 ± 0.002 Å |
c | 21.022 ± 0.004 Å |
α | 90° |
β | 92.347 ± 0.014° |
γ | 90° |
Cell volume | 6548.7 ± 1.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/a 1 |
Hall space group symbol | -P 2yab |
Residual factor for all reflections | 0.0822 |
Residual factor for significantly intense reflections | 0.0669 |
Weighted residual factors for significantly intense reflections | 0.1997 |
Weighted residual factors for all reflections included in the refinement | 0.2159 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 1.5406 Å |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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