Crystallography Open Database

Information card for entry 7029485

Preview

Coordinates	7029485.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H32 Gd2 N8 O15 S2
Calculated formula	C40 H32 Gd2 N8 O15 S2
Title of publication	White light emission by a lanthanide doped Sm(iii) framework constructed from 4-sulfobenzoate and 1H-imidazo[4,5-f][1,10]-phenanthroline.
Authors of publication	Song, Shuang; Li, Xia; Zhang, Yi-Hua; Huo, Rui; Ma, Dou
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	16
Pages of publication	5974 - 5977
a	6.8982 ± 0.0004 Å
b	10.1549 ± 0.0006 Å
c	15.2233 ± 0.0008 Å
α	83.812 ± 0.001°
β	78.138 ± 0.001°
γ	77.515 ± 0.001°
Cell volume	1016.71 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0252
Residual factor for significantly intense reflections	0.0232
Weighted residual factors for significantly intense reflections	0.0639
Weighted residual factors for all reflections included in the refinement	0.0653
Goodness-of-fit parameter for all reflections included in the refinement	0.916
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
180000 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/94.	7029485.cif
108320	2014-03-30	cif/ Adding structures of 7029484, 7029485, 7029486, 7029487 via cif-deposit CGI script.	7029485.cif