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Information card for entry 4083850
Preview
Coordinates | 4083850.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C35 H41 B Co F9 N2 P2 |
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Calculated formula | C35 H41 B Co F9 N2 P2 |
SMILES | [CoH]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)c(F)c(F)c1F.[B](F)(F)(F)[F-] |
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 | 8.361 ± 0.002 Å |
b | 10.159 ± 0.003 Å |
c | 20.994 ± 0.005 Å |
α | 76.151 ± 0.01° |
β | 82.519 ± 0.008° |
γ | 75.569 ± 0.008° |
Cell volume | 1672 ± 0.8 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1118 |
Residual factor for significantly intense reflections | 0.0517 |
Weighted residual factors for significantly intense reflections | 0.0794 |
Weighted residual factors for all reflections included in the refinement | 0.0951 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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