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Information card for entry 4026058
Preview
Coordinates | 4026058.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C10 H14 F12 N2 O2 |
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Calculated formula | C10 H14 F12 N2 O2 |
Title of publication | Influence of the Structure of Polyfluorinated Alcohols on Brønsted Acidity/Hydrogen-Bond Donor Ability and Consequences on the Promoter Effect |
Authors of publication | Daniela Vuluga; Julien Legros; Benoit Crousse; Alexandra M. Z. Slawin; Christian Laurence; Pierre Nicolet; Danièle Bonnet-Delpon |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2011 |
Journal volume | 76 |
Pages of publication | 1126 - 1133 |
a | 5.121 ± 0.002 Å |
b | 12.152 ± 0.006 Å |
c | 12.407 ± 0.006 Å |
α | 93.69 ± 0.02° |
β | 94.64 ± 0.02° |
γ | 96.93 ± 0.02° |
Cell volume | 761.8 ± 0.6 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1191 |
Residual factor for significantly intense reflections | 0.0833 |
Weighted residual factors for significantly intense reflections | 0.1896 |
Weighted residual factors for all reflections included in the refinement | 0.2115 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4026058.html
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structural data.