Crystallography Open Database

Information card for entry 4066159

Preview

Coordinates	4066159.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H13 Cl O3 S Sn2 W
Calculated formula	C11 H13 Cl O3 S Sn2 W
Title of publication	Half-Sandwich Tungsten Complexes with Metal- and η5-Cyclopentadienyl-Bound Functional Stannyl Groups and Their Transformation intoAnsaComplexes†
Authors of publication	Bera, Holger; Braunschweig, Holger; Dörfler, Rainer; Kupfer, Thomas; Radacki, Krzysztof; Seeler, Fabian
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	21
Pages of publication	5111
a	8.5946 ± 0.0003 Å
b	8.6557 ± 0.0003 Å
c	12.2209 ± 0.0004 Å
α	95.284 ± 0.002°
β	103.395 ± 0.002°
γ	106.793 ± 0.002°
Cell volume	834.26 ± 0.05 Å³
Cell temperature	101 ± 2 K
Ambient diffraction temperature	101 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0229
Residual factor for significantly intense reflections	0.0203
Weighted residual factors for significantly intense reflections	0.0425
Weighted residual factors for all reflections included in the refinement	0.0432
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4066159.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4066159.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4066159.cif
33808	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4066155, 4066156, 4066157, 4066158, 4066159 via cif-deposit CGI script.	4066159.cif