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Information card for entry 4123700
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Coordinates | 4123700.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H40 Cu N6 O7 |
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Calculated formula | C21 H40 Cu N6 O7 |
Title of publication | Redox Non-innocent Ligand Controls Water Oxidation Overpotential in a New Family of Mononuclear Cu-Based Efficient Catalysts. |
Authors of publication | Garrido-Barros, Pablo; Funes-Ardoiz, Ignacio; Drouet, Samuel; Benet-Buchholz, Jordi; Maseras, Feliu; Llobet, Antoni |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2015 |
Journal volume | 137 |
Journal issue | 21 |
Pages of publication | 6758 - 6761 |
a | 11.9851 ± 0.0019 Å |
b | 16.023 ± 0.003 Å |
c | 26.249 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5040.8 ± 1.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0932 |
Residual factor for significantly intense reflections | 0.0701 |
Weighted residual factors for significantly intense reflections | 0.1342 |
Weighted residual factors for all reflections included in the refinement | 0.1421 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.321 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4123700.html
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