Crystallography Open Database

Information card for entry 7205537

7205536 << 7205537 >> 7205538

Preview

Coordinates	7205537.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H10 K6 O82.99 P2 Rb2 Sn2 W19
Calculated formula	C12 H10 K6 O82.99 P2 Rb2 Sn2 W19
Title of publication	Controlled synthesis of a functionalized polytungstate ligand and a {MaMbMc(PW9)2} sandwich complex
Authors of publication	Cao, Rui; O'Halloran, Kevin P.; Hillesheim, Daniel A.; Lense, Sheri; Hardcastle, Kenneth I.; Hill, Craig L.
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	3
Pages of publication	738
a	32.678 ± 0.004 Å
b	14.1708 ± 0.0019 Å
c	39.662 ± 0.005 Å
α	90°
β	94.992 ± 0.002°
γ	90°
Cell volume	18297 ± 4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0747
Residual factor for significantly intense reflections	0.0458
Weighted residual factors for significantly intense reflections	0.1331
Weighted residual factors for all reflections included in the refinement	0.1508
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
180386 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/55.	7205537.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205537.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205537.cif
14784	2011-03-11	../uploads/cif-deposit/cod/cif Adding structures of 7205535, 7205536, 7205537, 7205538 via cif-deposit CGI script.	7205537.cif