Crystallography Open Database

Information card for entry 7210768

Preview

Coordinates	7210768.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H128 Cl10 La2 N28 O57 Zn2
Calculated formula	C42 H42 Cl10 La2 N28 O26 Zn2
Title of publication	Coordination nanotubes self-assembled from cucurbit[7]uril and lanthanide cations
Authors of publication	Liang, Li-Li; Zhao, Yi; Zhang, Yun-Qian; Tao, Zhu; Xue, Sai-Feng; Zhu, Qian-Jiang; Liu, Jing-Xin
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	19
Pages of publication	3943
a	17.1365 ± 0.0014 Å
b	17.9392 ± 0.0015 Å
c	18.5138 ± 0.0015 Å
α	104.378 ± 0.003°
β	102.328 ± 0.003°
γ	110.919 ± 0.003°
Cell volume	4854.1 ± 0.7 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0743
Residual factor for significantly intense reflections	0.0512
Weighted residual factors for significantly intense reflections	0.1249
Weighted residual factors for all reflections included in the refinement	0.1342
Goodness-of-fit parameter for all reflections included in the refinement	0.945
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180438 (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 7/21/07.	7210768.cif
90119	2013-11-17	cif/ Adding structures of 7210768, 7210769, 7210770, 7210771, 7210772, 7210773, 7210774, 7210775, 7210776, 7210777, 7210778 via cif-deposit CGI script.	7210768.cif