Information card for entry 4508158
| Formula |
C32 H26 F2 N5 O6 S |
| Calculated formula |
C32 H26 F2 N5 O6 S |
| Title of publication |
Multicomponent System of NPS-1034, an Orally Administered Lung Cancer Drug Candidate, with Sulfonic Acids and Solid State Characterization |
| Authors of publication |
Lee, Jangmi; Park, Suzie; Yoon, Seon-Joo; Jung, Yong Woo; Byun, Youngjoo; Yuk, Soon Hong; Jeon, Min Keyong; Kang, Sung Kwon; Lee, Eun Hee |
| Journal of publication |
Crystal Growth & Design |
| Year of publication |
2013 |
| Journal volume |
13 |
| Journal issue |
9 |
| Pages of publication |
3958 |
| a |
8.9432 ± 0.0003 Å |
| b |
12.1904 ± 0.0004 Å |
| c |
18.6492 ± 0.0007 Å |
| α |
104.625 ± 0.002° |
| β |
100.492 ± 0.005° |
| γ |
93.696 ± 0.004° |
| Cell volume |
1921.31 ± 0.12 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1203 |
| Residual factor for significantly intense reflections |
0.0712 |
| Weighted residual factors for significantly intense reflections |
0.1916 |
| Weighted residual factors for all reflections included in the refinement |
0.2118 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.965 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/4508158.html
