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Information card for entry 7131279
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7131279.cif |
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Original paper (by DOI) | HTML |
Formula | C31 H35 Co N2 O3 |
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Calculated formula | C31 H35 Co N2 O3 |
SMILES | [Co]123([N](=Cc4c(O1)c(ccc4)C(C)(C)C)c1ccccc1[N]3=Cc1cccc(c1O2)C(C)(C)C)CC(=O)C |
Title of publication | C-H bond activations by the HO˙/(Salophen<sup><i>t</i>-Bu</sup>)Co(II) radical pair generated <i>via</i> homolysis of a terminal Co(III)-OH bond. |
Authors of publication | Zhang, Jia; Li, Songyi; Fang, Huayi |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2023 |
Journal volume | 59 |
Journal issue | 22 |
Pages of publication | 3245 - 3248 |
a | 12.3922 ± 0.0001 Å |
b | 16.0308 ± 0.0002 Å |
c | 27.8061 ± 0.0003 Å |
α | 90° |
β | 98.765 ± 0.001° |
γ | 90° |
Cell volume | 5459.36 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0332 |
Residual factor for significantly intense reflections | 0.0318 |
Weighted residual factors for significantly intense reflections | 0.0895 |
Weighted residual factors for all reflections included in the refinement | 0.0901 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/7131279.html
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