Crystallography Open Database

Information card for entry 7042725

Preview

Coordinates	7042725.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C201 H190 Eu4 N8 O34
Calculated formula	C201 H190 Eu4 N8 O34
Title of publication	Circularly Polarized Luminescence on dinuclear Tb(III) and Eu(III) complexes with (S-) and (R-) 2-Phenylpropionate
Authors of publication	Casanovas, Berta; Zinna, Francesco; Di Bari, Lorenzo; El Fallah, M. Salah; Font-Bardía, Mercè; Vicente, Ramon
Journal of publication	Dalton Trans.
Year of publication	2017
a	17.5649 ± 0.0009 Å
b	19.2624 ± 0.001 Å
c	26.7346 ± 0.0012 Å
α	90°
β	100.137 ± 0.002°
γ	90°
Cell volume	8904.2 ± 0.8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0596
Residual factor for significantly intense reflections	0.0283
Weighted residual factors for significantly intense reflections	0.0457
Weighted residual factors for all reflections included in the refinement	0.0493
Goodness-of-fit parameter for all reflections included in the refinement	0.941
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
198632 (current)	2017-07-11	cod/ (melanie@ameba.ibt.lt) Correcting the '_exptl_absorpt_correction_type' data item 'multi-scan' enumeration values with the help of the cif_fix_values script from the cod-tools package revision 5455. The following command was used : cif_fix_values --fix-misspelled src/cod-tools/trunk/data/replacement-values/replacement_values.lst $i \| cif_filter --no-exclude-publication-details -h $i \| sponge $i A total of 524 files were changed.	7042725.cif
195613	2017-04-20	cif/ Adding structures of 7042725, 7042726, 7042727, 7042728 via cif-deposit CGI script.	7042725.cif