Crystallography Open Database

Information card for entry 1565690

Preview

Coordinates	1565690.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H60 Br2 F36 Gd2 N8 O20
Calculated formula	C70 H60 Br2 F36 Gd2 N8 O20
Title of publication	Nitronyl nitroxide biradical-supported lanthanide hetero-spin compounds: Magnetic relaxation in Dy analogue
Authors of publication	Li, Hongdao; Xie, Jing; Xi, Lu; Zhai, Lijun; Niu, Yulan
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	499
Pages of publication	119188
a	11.91 ± 0.005 Å
b	16.937 ± 0.008 Å
c	23.503 ± 0.01 Å
α	97.778 ± 0.019°
β	93.331 ± 0.01°
γ	103.871 ± 0.008°
Cell volume	4540 ± 3 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 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	0.1999
Residual factor for significantly intense reflections	0.1458
Weighted residual factors for significantly intense reflections	0.304
Weighted residual factors for all reflections included in the refinement	0.3279
Goodness-of-fit parameter for all reflections included in the refinement	0.98
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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