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Information card for entry 7242747
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Coordinates | 7242747.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C51 H49 N3 O2 |
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Calculated formula | C51 H49 N3 O2 |
Title of publication | Understanding the remarkable difference in liquid crystal behaviour between secondary and tertiary amides: the synthesis and characterisation of new benzanilide-based liquid crystal dimers. |
Authors of publication | Imrie, Corrie T.; Strachan, Grant James; Harrison, William T.; Storey, John M. D. |
Journal of publication | Physical Chemistry Chemical Physics |
Year of publication | 2021 |
a | 21.61054 ± 0.00014 Å |
b | 13.8187 ± 0.00007 Å |
c | 28.98487 ± 0.00019 Å |
α | 90° |
β | 110.27 ± 0.0007° |
γ | 90° |
Cell volume | 8119.7 ± 0.09 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 n 1 |
Hall space group symbol | P -2yac |
Residual factor for all reflections | 0.1892 |
Residual factor for significantly intense reflections | 0.1861 |
Weighted residual factors for significantly intense reflections | 0.4471 |
Weighted residual factors for all reflections included in the refinement | 0.4545 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.096 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/7242747.html
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Users of the data should acknowledge the original authors of the
structural data.