Crystallography Open Database

Information card for entry 7231581

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Coordinates	7231581.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H5 O6 Sm
Calculated formula	C10 H5 O6 Sm
Title of publication	Temperature-dependent 3D structures of lanthanide coordination polymers based on dicarboxylate mixed ligands
Authors of publication	Chainok, Kittipong; Ponjan, Nutcha; Theppitak, Chatphorn; Khemthong, Phailyn; Kielar, Filip; Dungkaew, Winya; Zhou, Yan; Batten, Stuart R.
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	46
Pages of publication	7446
a	14.1351 ± 0.0006 Å
b	6.8443 ± 0.0003 Å
c	22.0442 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2132.66 ± 0.16 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0577
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.0972
Weighted residual factors for all reflections included in the refinement	0.1039
Goodness-of-fit parameter for all reflections included in the refinement	1.199
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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