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Information card for entry 7102338
Preview
Coordinates | 7102338.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H78 Cu4 I4 N2 P8 |
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Calculated formula | C44 H78 Cu4 I4 N2 P8 |
SMILES | [I]1[Cu]2([N]#CC)[I]3[Cu]41[I]1[Cu]([I][Cu]31[P]13C5(C(C)(C)C)P6C1(C6(P5C(C(C)(C)C)P23)C(C)(C)C)C(C)(C)C)([N]#CC)P1C(C(C)(C)C)P2C3(C(C)(C)C)[P]41C1(C2(P31)C(C)(C)C)C(C)(C)C |
Title of publication | Copper(I) mediated oligomerisation of a phosphaalkyne. |
Authors of publication | Vogel, Ulf; Nixon, John F; Scheer, Manfred |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2007 |
Journal issue | 47 |
Pages of publication | 5055 - 5057 |
a | 15.505 ± 0.003 Å |
b | 11.6415 ± 0.0018 Å |
c | 18.001 ± 0.003 Å |
α | 90° |
β | 111.426 ± 0.018° |
γ | 90° |
Cell volume | 3024.7 ± 1 Å3 |
Cell temperature | 104 ± 1 K |
Ambient diffraction temperature | 104 ± 1 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0536 |
Residual factor for significantly intense reflections | 0.0391 |
Weighted residual factors for significantly intense reflections | 0.0963 |
Weighted residual factors for all reflections included in the refinement | 0.1 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.937 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7102338.html
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