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CIF Information Card
Information card for 7151779
7151778 << 7151779 >> 7151780Preview
|
Coordinates |
7151779.cif |
Structure parameters
| Formula | - C25 H26 Cl3 N5 O3 - |
| Calculated formula | - C25 H26 Cl3 N5 O3 - |
| Title of publication | Disubstituted 2-phenyl-benzopyranopyrimidine derivatives as a new type of highly selective ligands for telomeric G-quadruplex DNA. |
| Authors of publication | Wu, Wei-Bin; Chen, Shu-Han; Hou, Jin-Qiang; Tan, Jia-Heng; Ou, Tian-Miao; Huang, Shi-Liang; Li, Ding; Gu, Lian-Quan; Huang, Zhi-Shu |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 8 |
| Pages of publication | 2975 - 2986 |
| a | 9.2025 ± 0.0003 Å |
| b | 11.0726 ± 0.0003 Å |
| c | 14.1584 ± 0.0004 Å |
| α | 83.548 ± 0.002° |
| β | 72.05 ± 0.002° |
| γ | 67.759 ± 0.003° |
| Cell volume | 1270.33 ± 0.07 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0335 |
| Residual factor for observed reflections | 0.0308 |
| Weighted residual factors for the observed reflections | 0.086 |
| Weighted residual factors for all reflections included in the refinement | 0.0894 |
| Goodness-of-fit parameter for observed reflections | 0.931 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |