Information card for entry 4030959
| Formula |
C48 H32 Br2 Cl6 O8 |
| Calculated formula |
C48 H32 Br2 Cl6 O8 |
| Title of publication |
Synthesis, Photochemical Properties, and Cytotoxicities of 2H-Naphtho[1,2-b]pyran and Its Photodimers. |
| Authors of publication |
Ota, Motohiro; Sasamori, Takahiro; Tokitoh, Norihiro; Onodera, Takefumi; Mizushina, Yoshiyuki; Kuramochi, Kouji; Tsubaki, Kazunori |
| Journal of publication |
The Journal of organic chemistry |
| Year of publication |
2015 |
| Journal volume |
80 |
| Journal issue |
11 |
| Pages of publication |
5687 - 5695 |
| a |
11.7891 ± 0.0001 Å |
| b |
17.3916 ± 0.0002 Å |
| c |
17.8781 ± 0.0003 Å |
| α |
74.6642 ± 0.0006° |
| β |
74.5511 ± 0.0006° |
| γ |
87.2285 ± 0.0008° |
| Cell volume |
3406.36 ± 0.08 Å3 |
| Cell temperature |
103 ± 2 K |
| Ambient diffraction temperature |
103 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1322 |
| Residual factor for significantly intense reflections |
0.0991 |
| Weighted residual factors for significantly intense reflections |
0.2467 |
| Weighted residual factors for all reflections included in the refinement |
0.2734 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.038 |
| Diffraction radiation wavelength |
0.71 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/4030959.html
