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Information card for entry 7211316
Preview
Coordinates | 7211316.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H47 Cl Ni O2 P2 |
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Calculated formula | C26 H47 Cl Ni O2 P2 |
SMILES | c12c3c(cc(c1O[P](C(C)C)(C(C)C)[Ni]2(Cl)[P](C(C)C)(C(C)C)O3)C(C)(C)C)C(C)(C)C |
Title of publication | Direct, one-pot synthesis of POCOP-type pincer complexes from metallic nickel |
Authors of publication | Vabre, Boris; Lindeperg, Fabien; Zargarian, Davit |
Journal of publication | Green Chemistry |
Year of publication | 2013 |
Journal volume | 15 |
Journal issue | 11 |
Pages of publication | 3188 |
a | 10.4275 ± 0.0004 Å |
b | 14.033 ± 0.0005 Å |
c | 20.573 ± 0.0007 Å |
α | 90° |
β | 101.18 ± 0.001° |
γ | 90° |
Cell volume | 2953.3 ± 0.18 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0464 |
Residual factor for significantly intense reflections | 0.0448 |
Weighted residual factors for significantly intense reflections | 0.1176 |
Weighted residual factors for all reflections included in the refinement | 0.1192 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
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/7211316.html
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