Crystallography Open Database

Information card for entry 4502675

Preview

Coordinates	4502675.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H40 Mo8 N12 O31 Zn
Calculated formula	C20 H32 Mo8 N12 O31 Zn
Title of publication	Polyoxometalate Supported Transition Metal Complexes: Synthesis, Crystal Structures, and Supramolecular Chemistry
Authors of publication	Arumuganathan, T.; Rao, A. Srinivasa; Das, Samar K.
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	10
Pages of publication	4272
a	20.377 ± 0.009 Å
b	10.406 ± 0.005 Å
c	21.189 ± 0.009 Å
α	90°
β	98.383 ± 0.007°
γ	90°
Cell volume	4445 ± 3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
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	0.0524
Residual factor for significantly intense reflections	0.0473
Weighted residual factors for significantly intense reflections	0.1325
Weighted residual factors for all reflections included in the refinement	0.1359
Goodness-of-fit parameter for all reflections included in the refinement	1.066
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
179557 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/26.	4502675.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502675.cif
36511	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502675 via cif-deposit CGI script.	4502675.cif