Crystallography Open Database

Information card for entry 7703147

Preview

Coordinates	7703147.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H30 Cl8 N20 O20.5 Th2
Calculated formula	C30 H30 Cl8 N20 O20.5 Th2
Title of publication	Thorium(iv) and uranium(vi) compounds of cucurbit[10]uril: from a one-dimensional nanotube to a supramolecular framework.
Authors of publication	Zhang, Yingjie; Lu, Kimbal; Liu, Ming; Karatchevtseva, Inna; Tao, Zhu; Wei, Gang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	2
Pages of publication	404 - 410
a	10.812 ± 0.002 Å
b	21.943 ± 0.004 Å
c	30.221 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	7170 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	71
Hermann-Mauguin space group symbol	I m m m
Hall space group symbol	-I 2 2
Residual factor for all reflections	0.063
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.1766
Weighted residual factors for all reflections included in the refinement	0.1821
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.7108 Å
Diffraction radiation type	silicondoublecrystalmonochromatedsynchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
246461 (current)	2020-01-03	cif/ Adding structures of 7703147, 7703148 via cif-deposit CGI script.	7703147.cif