Crystallography Open Database

Information card for entry 7157633

Preview

Coordinates	7157633.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24.25 H14.5 Br3 Cl0.5 N3 O
Calculated formula	C24.25 H14.5 Br3 Cl0.5 N3 O
Title of publication	Oxidative trimerization of indoles via water-assisted visible-light photoredox catalysis and the study of their anti-cancer activities.
Authors of publication	Cheng, Li-Ting; Luo, Sheng-Qi; Hong, Bor-Cherng; Chen, Chia-Ling; Li, Wen-Shan; Lee, Gene-Hsiang
Journal of publication	Organic & biomolecular chemistry
Year of publication	2020
Journal volume	18
Journal issue	32
Pages of publication	6247 - 6252
a	26.7209 ± 0.0006 Å
b	15.6427 ± 0.0003 Å
c	11.8698 ± 0.0003 Å
α	90°
β	104.361 ± 0.0004°
γ	90°
Cell volume	4806.38 ± 0.19 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0655
Residual factor for significantly intense reflections	0.0628
Weighted residual factors for significantly intense reflections	0.1673
Weighted residual factors for all reflections included in the refinement	0.1701
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
256164 (current)	2020-09-06	cif/ Updating files of 7157631, 7157632, 7157633, 7157634, 7157635 Original log message: Adding full bibliography for 7157631--7157635.cif.	7157633.cif
254667	2020-07-30	cif/ Adding structures of 7157631, 7157632, 7157633, 7157634, 7157635 via cif-deposit CGI script.	7157633.cif