Information card for entry 7200270
| Formula |
C31 H32 N6 O3 |
| Calculated formula |
C31 H31 N6 O3 |
| Title of publication |
Synthesis, crystal structures and nonlinear optical properties of three TCF-based chromophores |
| Authors of publication |
Li, Suyue; Li, Ming; Qin, Jingui; Tong, Mingliang; Chen, Xiaoming; Liu, Tao; Fu, Yang; Wu, Shuixing; Su, Zhongmin |
| Journal of publication |
CrystEngComm |
| Year of publication |
2009 |
| Journal volume |
11 |
| Journal issue |
4 |
| Pages of publication |
589 - 596 |
| a |
21.2261 ± 0.0018 Å |
| b |
7.0551 ± 0.0006 Å |
| c |
19.115 ± 0.0016 Å |
| α |
90° |
| β |
99.781 ± 0.001° |
| γ |
90° |
| Cell volume |
2820.9 ± 0.4 Å3 |
| Cell temperature |
123 ± 2 K |
| Ambient diffraction temperature |
123 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/c 1 |
| Hall space group symbol |
-P 2ybc |
| Residual factor for all reflections |
0.1084 |
| Residual factor for significantly intense reflections |
0.0971 |
| Weighted residual factors for significantly intense reflections |
0.2567 |
| Weighted residual factors for all reflections included in the refinement |
0.2649 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.07 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7200270.html
