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Information card for entry 4070642
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4070642.cif |
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Original paper (by DOI) | HTML |
Formula | C48 H52 N4 Ni2 O4 |
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Calculated formula | C48 H52 N4 Ni2 O4 |
SMILES | C12C(C=C3C(C=2)=[N](c2c(cccc2C)C)[Ni]2(OC(=CC(=[O]2)C)C)N3c2c(cccc2C)C)=[N](c2c(cccc2C)C)[Ni]2(OC(=CC(=[O]2)C)C)N1c1c(cccc1C)C |
Title of publication | Binuclear Nickel and Copper Complexes with Bridging 2,5-Diamino-1,4-benzoquinonediimines: Synthesis, Structures, and Catalytic Olefin Polymerization |
Authors of publication | Huang, Yuan-Biao; Tang, Guang-Rong; Jin, Gui-Ying; Jin, Guo-Xin |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 2 |
Pages of publication | 259 |
a | 7.651 ± 0.002 Å |
b | 11.783 ± 0.003 Å |
c | 13.848 ± 0.004 Å |
α | 114.862 ± 0.004° |
β | 99.241 ± 0.005° |
γ | 90.263 ± 0.005° |
Cell volume | 1114.4 ± 0.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1081 |
Residual factor for significantly intense reflections | 0.0663 |
Weighted residual factors for significantly intense reflections | 0.1446 |
Weighted residual factors for all reflections included in the refinement | 0.1627 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4070642.html
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Users of the data should acknowledge the original authors of the
structural data.