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Information card for entry 4134026
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Coordinates | 4134026.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | (tBudmx)Cu2(PPh3)2 |
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Formula | C96.88 H99.25 Cu2 N4 O P2 |
Calculated formula | C96.875 H99.25 Cu2 N4 O P2 |
Title of publication | Electronic Structures and Reactivity Profiles of Aryl Nitrenoid-Bridged Dicopper Complexes. |
Authors of publication | Carsch, Kurtis M.; Lukens, James T.; DiMucci, Ida M.; Iovan, Diana A.; Zheng, Shao-Liang; Lancaster, Kyle M.; Betley, Theodore A. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2020 |
a | 57.196 ± 0.011 Å |
b | 25.306 ± 0.004 Å |
c | 26.078 ± 0.003 Å |
α | 90° |
β | 117.092 ± 0.007° |
γ | 90° |
Cell volume | 33604 ± 9 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1338 |
Residual factor for significantly intense reflections | 0.0744 |
Weighted residual factors for significantly intense reflections | 0.1635 |
Weighted residual factors for all reflections included in the refinement | 0.1931 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
Diffraction radiation wavelength | 0.71073 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/4134026.html
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