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Information card for entry 4109914
Preview
Coordinates | 4109914.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H62 B F4 N O Os P2 |
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Calculated formula | C38 H62 B F4 N O Os P2 |
Title of publication | Understanding the Formation of N-H Tautomers from α-Substituted Pyridines: Tautomerization of 2-Ethylpyridine Promoted by Osmium |
Authors of publication | María L. Buil; Miguel A. Esteruelas; Karin Garcés; Montserrat Oliván; Enrique Oñate |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Pages of publication | 10998 - 10999 |
a | 23.589 ± 0.002 Å |
b | 20.399 ± 0.002 Å |
c | 19.951 ± 0.002 Å |
α | 90° |
β | 125.574 ± 0.002° |
γ | 90° |
Cell volume | 7808.5 ± 1.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
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 | 0.0688 |
Residual factor for significantly intense reflections | 0.0396 |
Weighted residual factors for significantly intense reflections | 0.07 |
Weighted residual factors for all reflections included in the refinement | 0.0756 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.82 |
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/4109914.html
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structural data.