Crystallography Open Database

Information card for entry 1573837

Preview

Coordinates	1573837.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H33 F6 N2 O6 P
Calculated formula	C18 H33 F6 N2 O6 P
SMILES	[P](F)(F)(F)(F)(F)[F-].O1CCOCCOCCOCCOCCOCC1.[NH3+]Cc1ccncc1
Title of publication	Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions.
Authors of publication	Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	9
Pages of publication	4101 - 4108
a	12.137 ± 0.003 Å
b	10.6827 ± 0.0016 Å
c	20.015 ± 0.006 Å
α	90°
β	100.751 ± 0.015°
γ	90°
Cell volume	2549.5 ± 1.1 Å³
Cell temperature	423 K
Ambient diffraction temperature	423 K
Number of distinct elements	6
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	0.297
Residual factor for significantly intense reflections	0.1446
Weighted residual factors for significantly intense reflections	0.3005
Weighted residual factors for all reflections included in the refinement	0.3477
Goodness-of-fit parameter for all reflections included in the refinement	1.173
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
298154 (current)	2025-03-04	cif/ Updating files of 1573833, 1573834, 1573835, 1573836, 1573837, 1573838 Original log message: Adding full bibliography for 1573833--1573838.cif.	1573837.cif
297568	2025-02-03	cif/ Adding structures of 1573833, 1573834, 1573835, 1573836, 1573837, 1573838 via cif-deposit CGI script.	1573837.cif