Crystallography Open Database

Information card for entry 4506422

Preview

Coordinates	4506422.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H54 Ag3 N12 O46 P W12
Calculated formula	C42 H42 Ag3 N12 O46 P W12
Title of publication	Assembly of Polyoxometalate-Based Metal‒Organic Frameworks with Silver(I)-Schiff Base Coordination Polymeric Chains as Building Blocks
Authors of publication	Dang, Dongbin; Zheng, Yanning; Bai, Yan; Guo, Xiangyang; Ma, Pengtao; Niu, Jingyang
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	8
Pages of publication	3856
a	12.1944 ± 0.0008 Å
b	20.2254 ± 0.0013 Å
c	17.5747 ± 0.0011 Å
α	90°
β	96.757 ± 0.001°
γ	90°
Cell volume	4304.5 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1045
Residual factor for significantly intense reflections	0.0536
Weighted residual factors for significantly intense reflections	0.1076
Weighted residual factors for all reflections included in the refinement	0.1203
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
179600 (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 4/50/64.	4506422.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4506422.cif
66154	2012-09-09	cif/ Adding structures of 4506421, 4506422, 4506423, 4506424, 4506425, 4506426 via cif-deposit CGI script.	4506422.cif