Crystallography Open Database

Information card for entry 1557440

Preview

Coordinates	1557440.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C173 H189 F24 N24 O37.5 Rh6 S8 Sr
Calculated formula	C173 H168 F24 N24 O34.5 Rh6 S8 Sr
Title of publication	s-Block metal ions induce structural transformations between figure-eight and double trefoil knots
Authors of publication	Dang, Li-Long; Gao, Xiang; Lin, Yue-Jian; Jin, Guo-Xin
Journal of publication	Chemical Science
Year of publication	2020
Journal volume	11
Journal issue	5
Pages of publication	1226 - 1232
a	22.564 ± 0.003 Å
b	22.564 ± 0.003 Å
c	20.375 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	8984 ± 2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.1109
Residual factor for significantly intense reflections	0.1065
Weighted residual factors for significantly intense reflections	0.3181
Weighted residual factors for all reflections included in the refinement	0.3222
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	1.34138 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257310 (current)	2020-10-06	cif/ Updating files of 1557437, 1557438, 1557439, 1557440, 1557441 Original log message: Adding full bibliography for 1557437--1557441.cif.	1557440.cif
248748	2020-03-04	cif/ Adding structures of 1557437, 1557438, 1557439, 1557440, 1557441 via cif-deposit CGI script.	1557440.cif