Crystallography Open Database

Information card for entry 7025395

Preview

Coordinates	7025395.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H33 N6 O14 Tb
Calculated formula	C27 H33 N6 O14 Tb
SMILES	[Tb]123456(OC(=O)c7[n]6c(C(=O)O2)ccc7)([n]2c(C(=O)O1)cccc2C(=O)O4)[n]1c(C(=O)O5)cccc1C(=O)O3.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.O.O
Title of publication	Efficient, stable, tunable, and easy to synthesize, handle and recycle luminescent materials: [H2NMe2]3[Ln(III)(2,6-dipicolinolate)3] (Ln = Eu, Tb, or its solid solutions).
Authors of publication	Mooibroek, Tiddo Jonathan; Gamez, Patrick; Pevec, Andrej; Kasunic, Marta; Kozlevcar, Bojan; Fu, Wen-Tian; Reedijk, Jan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	28
Pages of publication	6483 - 6487
a	10.6792 ± 0.0001 Å
b	17.0739 ± 0.0003 Å
c	18.7096 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3411.43 ± 0.09 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P c 21 n
Hall space group symbol	P -2n -2ac
Residual factor for all reflections	0.045
Residual factor for significantly intense reflections	0.03
Weighted residual factors for all reflections	0.041
Weighted residual factors for all reflections included in the refinement	0.024
Goodness-of-fit parameter for all reflections	1.752
Goodness-of-fit parameter for all reflections included in the refinement	1.114
Diffraction radiation wavelength	0.71072 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7025395.cif
93018	2014-01-12	cif/ Adding structures of 7025394, 7025395 via cif-deposit CGI script.	7025395.cif