Crystallography Open Database

Information card for entry 4064706

Preview

Coordinates	4064706.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H86 K2 N4 O5 S4 Si2
Calculated formula	C50 H86 K2 N4 O5 S4 Si2
Title of publication	Synthesis and Characterization of an Amidinate-Stabilized Siladithiocarboxylate and Its Germanium(II) Complex
Authors of publication	Zhang, Shu-Hua; Xi, Hong-Wei; Lim, Kok Hwa; So, Cheuk-Wai
Journal of publication	Organometallics
Year of publication	2011
Journal volume	30
Journal issue	13
Pages of publication	3686
a	11.1594 ± 0.0008 Å
b	11.4396 ± 0.0008 Å
c	12.4599 ± 0.0009 Å
α	87.13 ± 0.003°
β	72.379 ± 0.004°
γ	74.688 ± 0.003°
Cell volume	1461.4 ± 0.18 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 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	0.0471
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.1023
Weighted residual factors for all reflections included in the refinement	0.123
Goodness-of-fit parameter for all reflections included in the refinement	1.128
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
178541 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/47.	4064706.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4064706.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4064706.cif
33011	2012-02-11	../uploads/cif-deposit/cod/cif Adding structures of 4064706, 4064707 via cif-deposit CGI script.	4064706.cif