Crystallography Open Database

Information card for entry 7155369

Preview

Coordinates	7155369.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H39 N5
Calculated formula	C44 H39 N5
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	18.6 ± 0.01 Å
b	9.144 ± 0.006 Å
c	23.69 ± 0.01 Å
α	90°
β	105.818 ± 0.009°
γ	90°
Cell volume	3877 ± 4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
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	0.1993
Residual factor for significantly intense reflections	0.0631
Weighted residual factors for significantly intense reflections	0.0975
Weighted residual factors for all reflections included in the refinement	0.1141
Goodness-of-fit parameter for all reflections included in the refinement	1.136
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
191753 (current)	2017-02-04	cif/ Updating files of 7155369, 7155370, 7155371, 7155372, 7155373 Original log message: Adding full bibliography for 7155369--7155373.cif.	7155369.cif
188622	2016-11-22	cif/ Adding structures of 7155369, 7155370, 7155371, 7155372, 7155373 via cif-deposit CGI script.	7155369.cif