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Information card for entry 4121904
Preview
Coordinates | 4121904.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H28 Cl4 Cu N4 O4 |
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Calculated formula | C31 H28 Cl4 Cu N4 O4 |
Title of publication | Halide-Promoted Dioxygenolysis of a Carbon-Carbon Bond by a Copper(II) Diketonate Complex. |
Authors of publication | Allpress, Caleb J.; Miłaczewska, Anna; Borowski, Tomasz; Bennett, Jami R.; Tierney, David L.; Arif, Atta M.; Berreau, Lisa M. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 22 |
Pages of publication | 7821 |
a | 13.1354 ± 0.0002 Å |
b | 15.4508 ± 0.0003 Å |
c | 15.3363 ± 0.0003 Å |
α | 90° |
β | 90.3769 ± 0.0012° |
γ | 90° |
Cell volume | 3112.47 ± 0.1 Å3 |
Cell temperature | 150 ± 1 K |
Ambient diffraction temperature | 150 ± 1 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/a 1 |
Hall space group symbol | -P 2yab |
Residual factor for all reflections | 0.0631 |
Residual factor for significantly intense reflections | 0.0394 |
Weighted residual factors for significantly intense reflections | 0.097 |
Weighted residual factors for all reflections included in the refinement | 0.1098 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4121904.html
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