Crystallography Open Database

Information card for entry 4312247

Preview

Coordinates	4312247.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H72 O4 P2 Si4 Sr
Calculated formula	C38 H72 O4 P2 Si4 Sr
Title of publication	Complexes of the Heavier Alkaline Earth Metals Ca, Sr, and Ba with O-Functionalized Phosphanide Ligands
Authors of publication	Stuart Blair; Keith Izod; William Clegg; Ross W. Harrington
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	8526 - 8531
a	12.2184 ± 0.0018 Å
b	17.818 ± 0.003 Å
c	12.5916 ± 0.0018 Å
α	90°
β	118.471 ± 0.002°
γ	90°
Cell volume	2409.8 ± 0.6 Å³
Cell temperature	160 ± 2 K
Ambient diffraction temperature	160 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.107
Residual factor for significantly intense reflections	0.0782
Weighted residual factors for significantly intense reflections	0.1942
Weighted residual factors for all reflections included in the refinement	0.2113
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179161 (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 4/31/22.	4312247.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4312247.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4312247.cif
3752	2010-11-17	../uploads/cif-deposit/cod/cif Adding structures of 4312247 via cif-deposit CGI script.	4312247.cif