Crystallography Open Database

Information card for entry 4314962

Preview

Coordinates	4314962.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H54 O6 Sn Zr
Calculated formula	C27.588 H55.588 O6 Sn Zr
Title of publication	Syntheses and Structures of Cationic and Neutral, Homo- and Heteroleptic tert-Butoxides of the Group 4 Metals
Authors of publication	Edmond Y. Njua; Alexander Steiner; Lothar Stahl
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	2163 - 2172
a	17.1304 ± 0.0012 Å
b	17.1304 ± 0.0012 Å
c	9.489 ± 0.0014 Å
α	90°
β	90°
γ	120°
Cell volume	2411.5 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	156
Hermann-Mauguin space group symbol	P 3 m 1
Hall space group symbol	P 3 -2"
Residual factor for all reflections	0.0589
Residual factor for significantly intense reflections	0.0519
Weighted residual factors for significantly intense reflections	0.1329
Weighted residual factors for all reflections included in the refinement	0.14
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
179229 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/49.	4314962.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4314962.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4314962.cif
8105	2011-02-03	../uploads/cif-deposit/cod/cif Adding structures of 4314962 via cif-deposit CGI script.	4314962.cif