Crystallography Open Database

Information card for entry 7156629

Preview

Coordinates	7156629.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H18 N2 O2
Calculated formula	C27 H18 N2 O2
Title of publication	Synthesis of cyano-substituted carbazoles via successive C-C/C-H cleavage.
Authors of publication	Yang, Yajie; Huang, Jiaqi; Tan, Hailu; Kong, Lingkai; Wang, Mengdan; Yuan, Yang; Li, Yanzhong
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	4
Pages of publication	958 - 965
a	16.4009 ± 0.0008 Å
b	7.8236 ± 0.0004 Å
c	31.4855 ± 0.0017 Å
α	90°
β	102.498 ± 0.003°
γ	90°
Cell volume	3944.3 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
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	0.0497
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.1154
Weighted residual factors for all reflections included in the refinement	0.1199
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
225131 (current)	2019-11-08	cif/ Updating files of 7156627, 7156628, 7156629 Original log message: Adding full bibliography for 7156627--7156629.cif.	7156629.cif
212986	2019-01-11	cif/ Adding structures of 7156627, 7156628, 7156629 via cif-deposit CGI script.	7156629.cif