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Information card for entry 4033871
Preview
Coordinates | 4033871.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H40 N4 O4 |
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Calculated formula | C38 H40 N4 O4 |
Title of publication | Reverse Turn and Loop Secondary Structures in Stereodefined Cyclic Peptoid Scaffolds. |
Authors of publication | D'Amato, Assunta; Pierri, Giovanni; Tedesco, Consiglia; Della Sala, Giorgio; Izzo, Irene; Costabile, Chiara; De Riccardis, Francesco |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2019 |
Journal volume | 84 |
Journal issue | 17 |
Pages of publication | 10911 - 10928 |
a | 8.9528 ± 0.0011 Å |
b | 11.419 ± 0.003 Å |
c | 15.863 ± 0.002 Å |
α | 90° |
β | 93.945 ± 0.012° |
γ | 90° |
Cell volume | 1617.9 ± 0.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0513 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.1052 |
Weighted residual factors for all reflections included in the refinement | 0.1116 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
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/4033871.html
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