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Information card for entry 4074857
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Coordinates | 4074857.cif |
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Original paper (by DOI) | HTML |
Formula | C48 H40 Br N Ni P2 |
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Calculated formula | C48 H40 Br N Ni P2 |
SMILES | c1(ccccc1)[P]1(c2ccccc2)c2ccccc2N2[Ni]1(Br)[P](c1ccccc1)(c1ccccc1)c1ccccc21.c1ccccc1.c1ccccc1 |
Title of publication | Amido Pincer Complexes of Nickel(II): Synthesis, Structure, and Reactivity |
Authors of publication | Liang, Lan-Chang; Chien, Pin-Shu; Lin, Jia-Ming; Huang, Mei-Hui; Huang, Yu-Lun; Liao, Ju-Hsiou |
Journal of publication | Organometallics |
Year of publication | 2006 |
Journal volume | 25 |
Journal issue | 6 |
Pages of publication | 1399 - 1411 |
a | 24.288 ± 0.0007 Å |
b | 9.732 ± 0.0003 Å |
c | 18.409 ± 0.0007 Å |
α | 90° |
β | 113.052 ± 0.001° |
γ | 90° |
Cell volume | 4003.9 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1015 |
Residual factor for significantly intense reflections | 0.0654 |
Weighted residual factors for significantly intense reflections | 0.1418 |
Weighted residual factors for all reflections included in the refinement | 0.1803 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.214 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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