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Information card for entry 7207670
Preview
Coordinates | 7207670.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | ?[Co2(Biphen)2(3-pic)4].2(BiphenH2) |
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Formula | C72 H64 Co2 N4 O8 |
Calculated formula | C72 H64 Co2 N4 O8 |
SMILES | c12ccccc1c1ccccc1O[Co]1([n]3ccc(C)cc3)([n]3ccc(cc3)C)[O]2[Co]2([n]3ccc(C)cc3)([n]3ccc(C)cc3)[O]1c1ccccc1c1ccccc1O2.Oc1ccccc1c1ccccc1O.Oc1ccccc1c1ccccc1O |
Title of publication | Old dog, new tricks: 2,2′-biphenol as a bridging and book-end ligand in discrete and extended Co(ii) architectures |
Authors of publication | Berg, Nelly; Taylor, Stephanie M.; Prescimone, Alessandro; Brechin, Euan. K.; Jones, Leigh F. |
Journal of publication | CrystEngComm |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 8 |
Pages of publication | 2732 |
a | 11.119 ± 0.002 Å |
b | 12.486 ± 0.003 Å |
c | 13.342 ± 0.003 Å |
α | 111.49 ± 0.03° |
β | 113.74 ± 0.03° |
γ | 95.46 ± 0.03° |
Cell volume | 1512.3 ± 0.9 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.0489 |
Residual factor for significantly intense reflections | 0.0337 |
Weighted residual factors for significantly intense reflections | 0.0767 |
Weighted residual factors for all reflections included in the refinement | 0.0811 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7207670.html
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Users of the data should acknowledge the original authors of the
structural data.