Crystallography Open Database

Information card for entry 1557971

Preview

Coordinates	1557971.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H17 F6 N2 P
Calculated formula	C17 H17 F6 N2 P
SMILES	[P](F)(F)(F)(F)(F)[F-].[n+]1(CC)ccc(/C=C/c2c3ccccc3[nH]c2)cc1
Title of publication	Cancer cell discrimination and dynamic viability monitoring through wash-free bioimaging using AIEgens
Authors of publication	Zhang, Ruoyao; Niu, Guangle; Lu, Qing; Huang, Xiaolin; Chau, Joe H. C.; Kwok, Ryan T. K.; Yu, Xiaoqiang; Li, Min-Hui; Lam, Jacky W. Y.; Tang, Ben Zhong
Journal of publication	Chemical Science
Year of publication	2020
Journal volume	11
Journal issue	29
Pages of publication	7676 - 7684
a	6.8004 ± 0.0009 Å
b	11.9948 ± 0.0015 Å
c	21.5 ± 0.003 Å
α	90°
β	95.373 ± 0.004°
γ	90°
Cell volume	1746 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
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	0.0876
Residual factor for significantly intense reflections	0.0851
Weighted residual factors for significantly intense reflections	0.2292
Weighted residual factors for all reflections included in the refinement	0.2315
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257280 (current)	2020-10-06	cif/ Updating files of 1557971 Original log message: Adding full bibliography for 1557971.cif.	1557971.cif
254935	2020-08-06	cif/ Updating files of 1557971 Original log message: Adding full bibliography for 1557971.cif.	1557971.cif
251335	2020-05-01	cif/ Adding structures of 1557971 via cif-deposit CGI script.	1557971.cif