Crystallography Open Database

Information card for entry 7207498

7207497 << 7207498 >> 7207499

Preview

Coordinates	7207498.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H22 Cl2 N2 O6 S3
Calculated formula	C23.003 H22 Cl2.006 N2 O6 S3
Title of publication	Chemical doping of EDOT azomethine derivatives: insight into the oxidative and hydrolytic stability
Authors of publication	Bolduc, Andréanne; Dufresne, Stéphane; Skene, W. G.
Journal of publication	Journal of Materials Chemistry
Year of publication	2012
Journal volume	22
Journal issue	11
Pages of publication	5053
a	8.9605 ± 0.0002 Å
b	10.9189 ± 0.0003 Å
c	14.3701 ± 0.0004 Å
α	68.122 ± 0.001°
β	84.327 ± 0.002°
γ	85.734 ± 0.002°
Cell volume	1297.23 ± 0.06 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0895
Residual factor for significantly intense reflections	0.0674
Weighted residual factors for significantly intense reflections	0.1864
Weighted residual factors for all reflections included in the refinement	0.2004
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180405 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/74.	7207498.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207498.cif
37705	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7207498 via cif-deposit CGI script.	7207498.cif