Crystallography Open Database

Information card for entry 7156729

Preview

Coordinates	7156729.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H22 Cl N O
Calculated formula	C24 H22 Cl N O
Title of publication	A chemo- and regioselective C6-functionalization of 2,3-disubstituted indoles: highly efficient synthesis of diarylindol-6-ylmethanes.
Authors of publication	Wu, Qiong; Li, Gui-Lin; Yang, Shuang; Shi, Xiao-Qin; Huang, Tian-Zi; Du, Xi-Hua; Chen, Yan
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	13
Pages of publication	3462 - 3470
a	17.424 ± 0.003 Å
b	12.1 ± 0.002 Å
c	19.028 ± 0.003 Å
α	90°
β	101.189 ± 0.004°
γ	90°
Cell volume	3935.4 ± 1.1 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	5
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	0.1218
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.1126
Weighted residual factors for all reflections included in the refinement	0.145
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
225198 (current)	2019-11-08	cif/ Updating files of 7156729 Original log message: Adding full bibliography for 7156729.cif.	7156729.cif
214105	2019-03-13	cif/ Adding structures of 7156729 via cif-deposit CGI script.	7156729.cif