Crystallography Open Database

Information card for entry 4308569

Preview

Coordinates	4308569.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H6 N O8 S Sm
Calculated formula	C6 H6 N O8 S Sm
Title of publication	Coordination Polymers Based on Inorganic Lanthanide(III) Sulfate Skeletons and an Organic Isonicotinate N-oxide Connector: Segregation into Three Structural Types by the Lanthanide Contraction Effect
Authors of publication	Zheng He; En-Qing Gao; Zhe-Ming Wang; Chun-Hua Yan; Mohamedally Kurmoo
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	862 - 874
a	7.7706 ± 0.0002 Å
b	20.6308 ± 0.0007 Å
c	6.3439 ± 0.0002 Å
α	90°
β	106.712 ± 0.0014°
γ	90°
Cell volume	974.06 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0726
Residual factor for significantly intense reflections	0.0405
Weighted residual factors for significantly intense reflections	0.0808
Weighted residual factors for all reflections included in the refinement	0.0869
Goodness-of-fit parameter for all reflections included in the refinement	0.928
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4308569.html