Crystallography Open Database

Information card for entry 7155373

Preview

Coordinates	7155373.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H23 N3
Calculated formula	C32 H23 N3
SMILES	c12ccccc1n(c1c2cccc1)c1ccc(cc1)/C=C/c1ccc(cc1)/N=C/c1cnccc1
Title of publication	Intermolecular interactions boost aggregation induced emission in carbazole Schiff base derivatives.
Authors of publication	Gan, Xiaoping; Liu, Guangjin; Chu, Mingjie; Xi, Wengang; Ren, Zili; Zhang, Xiuli; Tian, Yupeng; Zhou, Hongping
Journal of publication	Organic & biomolecular chemistry
Year of publication	2016
Journal volume	15
Journal issue	1
Pages of publication	256 - 264
a	37.005 ± 0.008 Å
b	11.212 ± 0.002 Å
c	45.528 ± 0.01 Å
α	90°
β	91.208 ± 0.003°
γ	90°
Cell volume	18885 ± 7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
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	0.169
Residual factor for significantly intense reflections	0.0809
Weighted residual factors for significantly intense reflections	0.2257
Weighted residual factors for all reflections included in the refinement	0.3051
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
191753 (current)	2017-02-04	cif/ Updating files of 7155369, 7155370, 7155371, 7155372, 7155373 Original log message: Adding full bibliography for 7155369--7155373.cif.	7155373.cif
188622	2016-11-22	cif/ Adding structures of 7155369, 7155370, 7155371, 7155372, 7155373 via cif-deposit CGI script.	7155373.cif