Crystallography Open Database

Information card for entry 7200844

7200843 << 7200844 >> 7200845

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Coordinates	7200844.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H66 N29 O35 Re U
Calculated formula	C42 H66 N29 O35 Re U
Title of publication	Uranyl ion complexes of cucurbit[7]uril with zero-, one- and two-dimensionality
Authors of publication	Thuéry, Pierre
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	6
Pages of publication	1150
a	15.9084 ± 0.0006 Å
b	14.3646 ± 0.0006 Å
c	16.7141 ± 0.0008 Å
α	90°
β	116.386 ± 0.002°
γ	90°
Cell volume	3421.6 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0633
Residual factor for significantly intense reflections	0.0471
Weighted residual factors for significantly intense reflections	0.1205
Weighted residual factors for all reflections included in the refinement	0.1247
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
180339 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/08.	7200844.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7200844.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7200844.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7200844.cif