Crystallography Open Database

Information card for entry 7026872

Preview

Coordinates	7026872.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H74 O4 Sn2
Calculated formula	C62 H74 O4 Sn2
Title of publication	Synthesis and thermolytic behavior of tin(IV) formates: in search of recyclable metal-hydride systems.
Authors of publication	Ellis, Bobby D.; Atkins, Tonya M.; Peng, Yang; Sutton, Andrew D.; Gordon, John C.; Power, Philip P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	44
Pages of publication	10659 - 10663
a	8.6013 ± 0.0007 Å
b	16.5717 ± 0.0013 Å
c	18.8491 ± 0.0015 Å
α	80.211 ± 0.001°
β	84.368 ± 0.001°
γ	89.52 ± 0.001°
Cell volume	2634.7 ± 0.4 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0811
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.1348
Goodness-of-fit parameter for all reflections included in the refinement	1.104
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
179974 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/68.	7026872.cif
93624	2014-01-13	cif/ Adding structures of 7026869, 7026870, 7026871, 7026872 via cif-deposit CGI script.	7026872.cif