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Information card for entry 2312567
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Coordinates | 2312567.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | <i>N</i>-(1-Hydroxyethylidene)anilinium tetrafluoroborate–<i>N</i>-phenylacetamide (1/1) |
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Formula | C16 H19 B F4 N2 O2 |
Calculated formula | C16 H19 B F4 N2 O2 |
Title of publication | Salt forms of amides: protonation of acetanilide. |
Authors of publication | Jaconelli, Harry S.; Kennedy, Alan R. |
Journal of publication | Acta crystallographica. Section C, Structural chemistry |
Year of publication | 2024 |
Journal volume | 80 |
Journal issue | 9 |
a | 7.107 ± 0.0001 Å |
b | 9.5381 ± 0.0001 Å |
c | 13.3592 ± 0.0001 Å |
α | 98.765 ± 0.001° |
β | 98.034 ± 0.001° |
γ | 105.977 ± 0.001° |
Cell volume | 844.555 ± 0.017 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0365 |
Residual factor for significantly intense reflections | 0.0361 |
Weighted residual factors for significantly intense reflections | 0.0991 |
Weighted residual factors for all reflections included in the refinement | 0.0994 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2312567.html
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Users of the data should acknowledge the original authors of the
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