Information card for entry 1508929
| Common name |
CBTA-BPE-II |
| Chemical name |
cyclobutane-1,2,3,4-tetracarboxylic acid, (E)-1,2-di(pyridin-4-yl)ethene complex polymorph II |
| Formula |
C32 H28 N4 O8 |
| Calculated formula |
C32 H28 N4 O8 |
| Title of publication |
A product of a templated solid-state photodimerization acts as a template: single-crystal reactivity in a single polymorph of a cocrystal. |
| Authors of publication |
Bhattacharya, Suman; Stojaković, Jelena; Saha, Binoy K.; Macgillivray, Leonard R. |
| Journal of publication |
Organic letters |
| Year of publication |
2013 |
| Journal volume |
15 |
| Journal issue |
4 |
| Pages of publication |
744 - 747 |
| a |
7.3377 ± 0.0004 Å |
| b |
11.3673 ± 0.0007 Å |
| c |
18.0101 ± 0.0011 Å |
| α |
74.38 ± 0.005° |
| β |
90.072 ± 0.005° |
| γ |
70.386 ± 0.005° |
| Cell volume |
1355.82 ± 0.15 Å3 |
| Cell temperature |
130 ± 2 K |
| Ambient diffraction temperature |
130 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1213 |
| Residual factor for significantly intense reflections |
0.0818 |
| Weighted residual factors for significantly intense reflections |
0.1994 |
| Weighted residual factors for all reflections included in the refinement |
0.2291 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.045 |
| Diffraction radiation wavelength |
0.7107 Å |
| Diffraction radiation type |
MoKα |
| 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/1508929.html
