Crystallography Open Database

Information card for entry 7705435

Preview

Coordinates	7705435.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C65 H40.85 Gd3 N5 O22.5
Calculated formula	C65 H40.944 Gd3 N5 O22.5
Title of publication	A series of lanthanide(III) metal-organic frameworks derived from a pyridyl-dicarboxylate ligand: single-molecule magnet behaviour and luminescence properties.
Authors of publication	Zhang, Chengcheng; Ma, Xiufang; Cen, Peipei; Jin, Xiaoyong; Yang, Jinhui; Zhang, Yi-Quan; Ferrando-Soria, Jesús; Pardo, Emilio; Liu, Xiangyu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	40
Pages of publication	14123 - 14132
a	11.513 ± 0.003 Å
b	27.717 ± 0.006 Å
c	11.592 ± 0.003 Å
α	90°
β	102.164 ± 0.007°
γ	90°
Cell volume	3616 ± 1.5 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0532
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.1031
Weighted residual factors for all reflections included in the refinement	0.1086
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
258843 (current)	2020-11-06	cif/ Updating files of 7705434, 7705435, 7705436, 7705437 Original log message: Adding full bibliography for 7705434--7705437.cif.	7705435.cif
256449	2020-09-16	cif/ Adding structures of 7705434, 7705435, 7705436, 7705437 via cif-deposit CGI script.	7705435.cif