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Information card for entry 4325817
Preview
Coordinates | 4325817.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H45 Dy N6 Ni O15 |
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Calculated formula | C27 H45 Dy N6 Ni O15 |
SMILES | [Dy]123456([O]=N(=O)O[Ni]789%10[O]1c1c(cc(C)cc1[O]2C)C[N]7(CC[N]8(CC[N]9(Cc1c([O]3%10)c(cc(c1)C)[O]4C)C)C)C)([O]=N(=O)O6)ON(=[O]5)=O.CO.OC |
Title of publication | Strategy for the Rational Design of Asymmetric Triply Bridged Dinuclear 3d-4f Single-Molecule Magnets. |
Authors of publication | Enrique Colacio; José Ruiz-Sanchez; Fraser J. White; Euan K. Brechin |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 7268 - 7273 |
a | 10.5754 ± 0.0003 Å |
b | 21.0771 ± 0.0005 Å |
c | 16.4485 ± 0.0004 Å |
α | 90° |
β | 105.401 ± 0.001° |
γ | 90° |
Cell volume | 3534.69 ± 0.16 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0325 |
Residual factor for significantly intense reflections | 0.0246 |
Weighted residual factors for significantly intense reflections | 0.0526 |
Weighted residual factors for all reflections included in the refinement | 0.0552 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
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/4325817.html
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