Crystallography Open Database

Information card for entry 7249843

Preview

Coordinates	7249843.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H47 Cu Dy F30 N8 O16
Calculated formula	C59 H47 Cu Dy F30 N8 O16
Title of publication	Structure, magnetic properties and fluorescence selectivity of 1D chain complexes based on the pyrazolyl nitronyl nitroxide radical
Authors of publication	Chu, Jiamin; Liu, Yi; Li, Jing; Zhu, Mei
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	11
Pages of publication	1583 - 1590
a	12.0447 ± 0.0007 Å
b	16.704 ± 0.001 Å
c	20.5482 ± 0.0013 Å
α	111.44 ± 0.003°
β	92.035 ± 0.004°
γ	102.735 ± 0.004°
Cell volume	3722.6 ± 0.4 Å³
Cell temperature	193 K
Ambient diffraction temperature	193 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.117
Residual factor for significantly intense reflections	0.1011
Weighted residual factors for significantly intense reflections	0.2526
Weighted residual factors for all reflections included in the refinement	0.2738
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
298857 (current)	2025-04-05	cif/ Updating files of 7249842, 7249843, 7249844 Original log message: Adding full bibliography for 7249842--7249844.cif.	7249843.cif
297483	2025-01-28	cif/ Adding structures of 7249842, 7249843, 7249844 via cif-deposit CGI script.	7249843.cif