Crystallography Open Database

Information card for entry 7212193

Preview

Coordinates	7212193.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H48 N4 O12 Sm2
Calculated formula	C38 H48 N4 O12 Sm2
SMILES	[n]12[Sm]345(OC(=CC(=[O]3)C)C)(OC(=CC(=[O]4)C)C)(OC(=CC(=[O]5)C)C)[n]3c4c1[n](ccc2)[Sm]125([n]4ccc3)(OC(=CC(C)=[O]1)C)(OC(=CC(=[O]2)C)C)OC(=CC(=[O]5)C)C
Title of publication	White electroluminescence of lanthanide complexes resulting from exciplex formation
Authors of publication	Zucchi, Gaël; Jeon, Taewoo; Tondelier, Denis; Aldakov, Dmitry; Thuéry, Pierre; Ephritikhine, Michel; Geffroy, Bernard
Journal of publication	Journal of Materials Chemistry
Year of publication	2010
Journal volume	20
Journal issue	11
Pages of publication	2114
a	9.2497 ± 0.0007 Å
b	9.9437 ± 0.001 Å
c	12.4584 ± 0.0013 Å
α	107.516 ± 0.005°
β	96.94 ± 0.006°
γ	95.639 ± 0.006°
Cell volume	1073.71 ± 0.18 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0403
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.0736
Weighted residual factors for all reflections included in the refinement	0.0761
Goodness-of-fit parameter for all reflections included in the refinement	1.011
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
180452 (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 7/21/21.	7212193.cif
92697	2014-01-12	cif/ Adding structures of 7212191, 7212192, 7212193 via cif-deposit CGI script.	7212193.cif