Crystallography Open Database

Information card for entry 4003207

Preview

Coordinates	4003207.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H34 N6 S2 Sn2
Calculated formula	C22 H34 N6 S2 Sn2
SMILES	CN(C)C1=[N](c2ccccc2)[Sn]2([N](C)(C)[Sn]3([N]2(C)C)[N](=C(N(C)C)S3)c2ccccc2)S1
Title of publication	Polymorph-Selective Deposition of High Purity SnS Thin Films from a Single Source Precursor
Authors of publication	Ahmet, Ibbi Y.; Hill, Michael S.; Johnson, Andrew L.; Peter, Laurence M.
Journal of publication	Chemistry of Materials
Year of publication	2015
Journal volume	27
Journal issue	22
Pages of publication	7680
a	6.1351 ± 0.0001 Å
b	8.9483 ± 0.0002 Å
c	12.4437 ± 0.0003 Å
α	93.009 ± 0.001°
β	99.232 ± 0.001°
γ	94.8946 ± 0.0016°
Cell volume	670.31 ± 0.02 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0467
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.1103
Weighted residual factors for all reflections included in the refinement	0.1118
Goodness-of-fit parameter for all reflections included in the refinement	1.174
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
231428 (current)	2019-11-22	cif/ Adding structures of 4003207 via cif-deposit CGI script.	4003207.cif