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Information card for entry 4107177
Preview
Coordinates | 4107177.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C89 H53 N5 O10 |
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Calculated formula | C89 H53 N5 O10 |
Title of publication | Conformational Modulation of Sequence Recognition in Synthetic Macromolecules |
Authors of publication | Zhixue Zhu; Christine J. Cardin; Yu Gan; Claire A. Murray; Andrew J. P. White; David J. Williams; Howard M. Colquhoun |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 19442 - 19447 |
a | 15.9918 ± 0.0002 Å |
b | 35.2582 ± 0.0005 Å |
c | 26.4571 ± 0.0003 Å |
α | 90° |
β | 102.261 ± 0.001° |
γ | 90° |
Cell volume | 14577.4 ± 0.3 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1406 |
Residual factor for significantly intense reflections | 0.1122 |
Weighted residual factors for all reflections | 0.3069 |
Weighted residual factors for significantly intense reflections | 0.2697 |
Weighted residual factors for all reflections included in the refinement | 0.3069 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.9523 |
Diffraction radiation wavelength | 1.5418 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/4107177.html
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Users of the data should acknowledge the original authors of the
structural data.