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Information card for entry 1519315
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Coordinates | 1519315.cif |
---|
Formula | C54 H60 N4 O6 |
---|---|
Calculated formula | C54 H60 N4 O6 |
Title of publication | 5,17-bis((6-methyl-2-pyridyl)amido)-25,26,27,28-tetrakis(propoxy)calix(4)arene |
Authors of publication | Lhotak, P. L.; Stibor, I.; Hursthouse, Michael B.; Light, Mark E.; Prokes, I.; Tucker, J. H. R.; Dudic, M.; Miyaji, H. |
Journal of publication | Crystal Structure Report Archive |
Year of publication | 2001 |
Pages of publication | 67 |
a | 24.7998 ± 0.0005 Å |
b | 16.6806 ± 0.0003 Å |
c | 24.9057 ± 0.0005 Å |
α | 90° |
β | 107.161 ± 0.003° |
γ | 90° |
Cell volume | 9844.2 ± 0.4 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 4 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/c 1 |
Hall space group symbol | -P 2yc |
Residual factor for all reflections | 0.1401 |
Residual factor for significantly intense reflections | 0.0626 |
Weighted residual factors for significantly intense reflections | 0.1491 |
Weighted residual factors for all reflections included in the refinement | 0.1796 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.983 |
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/1519315.html
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