Crystallography Open Database

Information card for entry 7025514

Preview

Coordinates	7025514.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H36 Ag Br N6 S3
Calculated formula	C15 H36 Ag Br N6 S3
Title of publication	Structural and spectroscopic studies of some adducts of silver(I) halides with thiourea and N-ethyl substituted thioureas.
Authors of publication	Bowmaker, Graham A.; Pakawatchai, Chaveng; Saithong, Saowanit; Skelton, Brian W.; White, Allan H.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	18
Pages of publication	4391 - 4404
a	12.5665 ± 0.0006 Å
b	12.5665 ± 0.0006 Å
c	9.5805 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	1310.23 ± 0.15 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	159
Hermann-Mauguin space group symbol	P 3 1 c
Hall space group symbol	P 3 -2c
Residual factor for all reflections	0.0533
Residual factor for significantly intense reflections	0.0364
Weighted residual factors for significantly intense reflections	0.0814
Weighted residual factors for all reflections included in the refinement	0.0904
Goodness-of-fit parameter for all reflections included in the refinement	1.042
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
179961 (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 7/02/55.	7025514.cif
93090	2014-01-12	cif/ Adding structures of 7025514, 7025515, 7025516, 7025517, 7025518, 7025519, 7025520, 7025521, 7025522, 7025523, 7025524, 7025525 via cif-deposit CGI script.	7025514.cif