Crystallography Open Database

Information card for entry 7219444

7219443 << 7219444 >> 7219445

Preview

Coordinates	7219444.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C75 H76 F36 N10 O20 Sm2
Calculated formula	C75 H76 F36 N10 O20 Sm2
Title of publication	A series of heterospin complexes based on lanthanides and pyridine biradicals: synthesis, structure and magnetic properties
Authors of publication	Tian, Li; Zhou, Shang Yong; Li, Xin; Li, Ting; Liu, Zhong Yi; Wang, Xiuguang
Journal of publication	RSC Adv.
Year of publication	2015
a	12.2813 ± 0.0015 Å
b	12.8859 ± 0.0016 Å
c	31.337 ± 0.004 Å
α	89.214 ± 0.002°
β	80.045 ± 0.002°
γ	75.205 ± 0.002°
Cell volume	4720.2 ± 1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0803
Residual factor for significantly intense reflections	0.0636
Weighted residual factors for significantly intense reflections	0.1321
Weighted residual factors for all reflections included in the refinement	0.1398
Goodness-of-fit parameter for all reflections included in the refinement	1.111
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
180525 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/94.	7219444.cif
130244	2015-01-31	cif/ Adding structures of 7219441, 7219442, 7219443, 7219444, 7219445, 7219446 via cif-deposit CGI script.	7219444.cif