Crystallography Open Database

Information card for entry 4336673

Preview

Coordinates	4336673.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H92 Cl8 Fe4 N8 S3 Sn4
Calculated formula	C72 H92 Cl8 Fe4 N8 S3 Sn4
Title of publication	Directed Formation of a Ferrocenyl-Decorated Organotin Sulfide Complex and Its Controlled Degradation
Authors of publication	Zhiliang You; Stefanie Dehnen
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12332 - 12334
a	17.603 ± 0.005 Å
b	17.958 ± 0.005 Å
c	25.862 ± 0.005 Å
α	90 ± 0.005°
β	94.608 ± 0.005°
γ	90 ± 0.005°
Cell volume	8149 ± 4 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1325
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for significantly intense reflections	0.0612
Weighted residual factors for all reflections included in the refinement	0.0786
Goodness-of-fit parameter for all reflections included in the refinement	0.843
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
179469 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/66.	4336673.cif
102680	2014-02-21	cif/ Adding structures of 4336673 via cif-deposit CGI script.	4336673.cif