Crystallography Open Database

Information card for entry 7249842

Preview

Coordinates	7249842.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H47 Cu F30 Gd N8 O16
Calculated formula	C59 H47 Cu F30 Gd 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	12.0459 ± 0.0009 Å
b	16.7225 ± 0.0013 Å
c	20.5508 ± 0.0015 Å
α	111.534 ± 0.002°
β	91.936 ± 0.002°
γ	102.731 ± 0.002°
Cell volume	3726 ± 0.5 Å³
Cell temperature	192.8 K
Ambient diffraction temperature	192.8 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	0.0949
Residual factor for significantly intense reflections	0.0653
Weighted residual factors for significantly intense reflections	0.1549
Weighted residual factors for all reflections included in the refinement	0.1779
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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