Crystallography Open Database

Information card for entry 7029338

Preview

Coordinates	7029338.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H53 Ag7 N30 O63 P2 W18
Calculated formula	C35 H46 Ag7 N30 O63 P2 W18
Title of publication	Three 3D silver-bis(triazole) metal-organic frameworks stabilized by high-connected Wells-Dawson polyoxometallates.
Authors of publication	Wang, Xiuli; Zhao, Dan; Tian, Aixiang; Ying, Jun
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	13
Pages of publication	5211 - 5220
a	16.6392 ± 0.0007 Å
b	23.1775 ± 0.001 Å
c	24.5939 ± 0.0011 Å
α	90°
β	95.935 ± 0.001°
γ	90°
Cell volume	9433.9 ± 0.7 Å³
Cell temperature	187 ± 2 K
Ambient diffraction temperature	187 ± 2 K
Number of distinct elements	7
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	0.0733
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.1086
Weighted residual factors for all reflections included in the refinement	0.1128
Goodness-of-fit parameter for all reflections included in the refinement	1.458
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
179999 (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 7/02/93.	7029338.cif
107124	2014-03-17	cif/ Adding structures of 7029337, 7029338, 7029339 via cif-deposit CGI script.	7029338.cif