Crystallography Open Database

Information card for entry 7239744

Preview

Coordinates	7239744.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H7 S
Calculated formula	C11 H7 S
Title of publication	Aggregation-induced emission compounds based on 9,10-diheteroarylanthracene and their applications in cell imaging
Authors of publication	Wang, Renjie; Liang, Yunfei; Liu, Gang; Pu, Shouzhi
Journal of publication	RSC Advances
Year of publication	2020
Journal volume	10
Journal issue	4
Pages of publication	2170 - 2179
a	9.8461 ± 0.0012 Å
b	9.2276 ± 0.0011 Å
c	10.1454 ± 0.0012 Å
α	90°
β	115.242 ± 0.002°
γ	90°
Cell volume	833.75 ± 0.17 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/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1733
Residual factor for significantly intense reflections	0.1595
Weighted residual factors for significantly intense reflections	0.4885
Weighted residual factors for all reflections included in the refinement	0.5128
Goodness-of-fit parameter for all reflections included in the refinement	2.478
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
258037 (current)	2020-10-06	cif/ Updating files of 7239744, 7239745, 7239746, 7239747 Original log message: Adding full bibliography for 7239744--7239747.cif.	7239744.cif
246731	2020-01-11	cif/ Adding structures of 7239744, 7239745, 7239746, 7239747 via cif-deposit CGI script.	7239744.cif