Crystallography Open Database

Information card for entry 7217896

Preview

Coordinates	7217896.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H29 N2 O3 P S2
Calculated formula	C25 H29 N2 O3 P S2
Title of publication	A mononuclear Dy(III) complex incoporating dithienylethene unit: crystalline-phase photochromism, magnetic and luminescent properties
Authors of publication	Cao, Deng-Ke; Wei, Ruo-Hong; Gu, Yan-Wei; Zhao, Yue; Ward, Mike D.
Journal of publication	RSC Adv.
Year of publication	2014
a	8.103 ± 0.003 Å
b	8.097 ± 0.003 Å
c	40.015 ± 0.014 Å
α	90°
β	90°
γ	90°
Cell volume	2625.4 ± 1.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0949
Residual factor for significantly intense reflections	0.0571
Weighted residual factors for significantly intense reflections	0.137
Weighted residual factors for all reflections included in the refinement	0.1576
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
180509 (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 7/21/78.	7217896.cif
122789	2014-09-05	cif/ Adding structures of 7217895, 7217896 via cif-deposit CGI script.	7217896.cif