Crystallography Open Database

Information card for entry 7235236

Preview

Coordinates	7235236.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H19 N O
Calculated formula	C23 H19 N O
Title of publication	Metal-free graphene oxide-catalyzed aza-semipinacol rearrangement to prepare 2-(indol-2-yl)phenols and benzofuro[3,2-b]indolines containing quaternary carbon centers
Authors of publication	Zhao, Hong-Ping; Liang, Gui-Chao; Nie, Shu-Min; Lu, Xiuqiang; Pan, Cheng-Xue; Zhong, Xin-Xian; Su, Gui-Fa; Mo, Dong-Liang
Journal of publication	Green Chemistry
Year of publication	2020
Journal volume	22
Journal issue	2
Pages of publication	404 - 410
a	12.012 ± 0.003 Å
b	9.465 ± 0.003 Å
c	15.801 ± 0.005 Å
α	90°
β	91.447 ± 0.005°
γ	90°
Cell volume	1795.9 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.075
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for significantly intense reflections	0.116
Weighted residual factors for all reflections included in the refinement	0.1352
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257595 (current)	2020-10-06	cif/ Updating files of 7235236 Original log message: Adding full bibliography for 7235236.cif.	7235236.cif
247763	2020-02-04	cif/ Updating files of 7235236 Original log message: Adding full bibliography for 7235236.cif.	7235236.cif
231111	2019-11-21	cif/ Adding structures of 7235236 via cif-deposit CGI script.	7235236.cif