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Information card for entry 4083852
Preview
Coordinates | 4083852.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H40 Co F4 N3 P2 |
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Calculated formula | C34 H40 Co F4 N3 P2 |
SMILES | [Co]12345([P]6(C(C)(C)C)CN(c7ccccc7)C[P]1(C(C)(C)C)CN(c1ccccc1)C6)[c]1([cH]2[cH]3[cH]4[cH]51)c1c(F)c(F)nc(F)c1F |
Title of publication | Cobalt Complexes Containing Pendant Amines in the Second Coordination Sphere as Electrocatalysts for H2Production |
Authors of publication | Fang, Ming; Wiedner, Eric S.; Dougherty, William G.; Kassel, W. Scott; Liu, Tianbiao; DuBois, Daniel L.; Bullock, R. Morris |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 20 |
Pages of publication | 5820 |
a | 12.4882 ± 0.0008 Å |
b | 12.5142 ± 0.0008 Å |
c | 22.1598 ± 0.0017 Å |
α | 73.638 ± 0.002° |
β | 74.976 ± 0.003° |
γ | 76.289 ± 0.002° |
Cell volume | 3158.6 ± 0.4 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0974 |
Residual factor for significantly intense reflections | 0.0468 |
Weighted residual factors for significantly intense reflections | 0.0868 |
Weighted residual factors for all reflections included in the refinement | 0.1007 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
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/4083852.html
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Users of the data should acknowledge the original authors of the
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