Crystallography Open Database

Information card for entry 7214984

Preview

Coordinates	7214984.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H182 Cl9 Gd3 N40 O80
Calculated formula	C66 H66 Cl9 Gd3 N40 O32
Title of publication	Hydroquinone-assisted assembly of coordination polymers from lanthanides and cucurbit[5]uril
Authors of publication	Chen, Kai; Liang, Li-Li; Liu, Hao-Jing; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Xiao, Xin; Zhu, Qian-Jiang; Lindoy, Leonard F.; Wei, Gang
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	23
Pages of publication	7994
a	17.065 ± 0.005 Å
b	18.41 ± 0.005 Å
c	24.35 ± 0.006 Å
α	105.555 ± 0.003°
β	100.01 ± 0.004°
γ	102.267 ± 0.004°
Cell volume	6982 ± 3 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 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	0.1006
Residual factor for significantly intense reflections	0.0642
Weighted residual factors for significantly intense reflections	0.1727
Weighted residual factors for all reflections included in the refinement	0.1884
Goodness-of-fit parameter for all reflections included in the refinement	0.954
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
180480 (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 7/21/49.	7214984.cif
111006	2014-04-20	cif/ Adding structures of 7214980, 7214981, 7214982, 7214983, 7214984, 7214985, 7214986, 7214987 via cif-deposit CGI script.	7214984.cif