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Information card for entry 4109227
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Coordinates | 4109227.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H62 B11 O2 |
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Calculated formula | C29 H62 B11 O2 |
Title of publication | Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges |
Authors of publication | Sergiy V. Rosokha; Jay K. Kochi |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Pages of publication | 3683 - 3697 |
a | 9.466 ± 0.004 Å |
b | 9.92 ± 0.004 Å |
c | 10.639 ± 0.005 Å |
α | 106.772 ± 0.009° |
β | 106.409 ± 0.008° |
γ | 95.298 ± 0.009° |
Cell volume | 901 ± 0.7 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1122 |
Residual factor for significantly intense reflections | 0.0709 |
Weighted residual factors for significantly intense reflections | 0.1749 |
Weighted residual factors for all reflections included in the refinement | 0.1955 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.231 |
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/4109227.html
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Users of the data should acknowledge the original authors of the
structural data.