Crystallography Open Database

Information card for entry 4111359

Preview

Coordinates	4111359.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	EuIII complex
Formula	C33 H26 Eu F9 N6 O16 S5
Calculated formula	C33 H26 Eu F9 N6 O16 S5
Title of publication	Thiophene-Derivatized Pybox and Its Highly Luminescent Lanthanide Ion Complexes
Authors of publication	Ana de Bettencourt-Dias; Subha Viswanathan; Alexandra Rollett
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	15436 - 15437
a	16.84 ± 0.003 Å
b	16.541 ± 0.004 Å
c	16.309 ± 0.003 Å
α	90°
β	104.57 ± 0.03°
γ	90°
Cell volume	4396.8 ± 1.7 Å³
Cell temperature	101 ± 2 K
Ambient diffraction temperature	101 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0547
Residual factor for significantly intense reflections	0.0504
Weighted residual factors for significantly intense reflections	0.1335
Weighted residual factors for all reflections included in the refinement	0.1373
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	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178884 (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 4/11/13.	4111359.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4111359.cif
60884	2012-06-18	cif/ Adding structures of 4111359 via cif-deposit CGI script.	4111359.cif