Crystallography Open Database

Information card for entry 4114993

Preview

Coordinates	4114993.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C221 H150 Eu7 F27 N46 O51 S9
Calculated formula	C218.07 H120 Eu7 F15 N46.05 O45.02 S8.97
Title of publication	Cation-Controlled Self-Assembly of a Hexameric Europium Wheel
Authors of publication	Yann Bretonnière; Marinella Mazzanti; Jacques Pécaut; Marilyn M. Olmstead
Journal of publication	Journal of the American Chemical Society
Year of publication	2002
Journal volume	124
Pages of publication	9012 - 9013
a	22.9958 ± 0.0007 Å
b	22.9958 ± 0.0007 Å
c	31.3192 ± 0.0017 Å
α	90°
β	90°
γ	120°
Cell volume	14342.9 ± 1 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	7
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.1466
Residual factor for significantly intense reflections	0.0607
Weighted residual factors for significantly intense reflections	0.1934
Weighted residual factors for all reflections included in the refinement	0.2288
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178920 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/49.	4114993.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114993.cif
68378	2012-10-26	cif/ Adding structures of 4114993 via cif-deposit CGI script.	4114993.cif