Crystallography Open Database

Information card for entry 7708942

Preview

Coordinates	7708942.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H72 N18 O58 S6 Sm4
Calculated formula	C60 H72 N18 O58 S6 Sm4
Title of publication	Self-assembled lanthanide-based helixes: synthetic control of the helical handedness by chirality of the ligand.
Authors of publication	Wu, Min-Yu; Xu, Jing-Xiang; Chen, Yi-Hsin; Lu, I-Chung; Han, Jeng-Liang; Lin, Po-Heng
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	51
Journal issue	1
Pages of publication	69 - 73
a	8.4352 ± 0.0004 Å
b	17.0889 ± 0.0008 Å
c	31.8495 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	4591.1 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150.15 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0369
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0929
Weighted residual factors for all reflections included in the refinement	0.103
Goodness-of-fit parameter for all reflections included in the refinement	1.29
Diffraction radiation wavelength	0.71076 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
272653 (current)	2022-02-04	cif/ Updating files of 7708942, 7708943, 7708944, 7708945, 7708946, 7708947 Original log message: Adding full bibliography for 7708942--7708947.cif.	7708942.cif
270884	2021-11-26	cif/ Adding structures of 7708942, 7708943, 7708944, 7708945, 7708946, 7708947 via cif-deposit CGI script.	7708942.cif