Crystallography Open Database

Information card for entry 7220593

7220592 << 7220593 >> 7220594

Preview

Coordinates	7220593.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H56 Ag10 N32 O41 P W12
Calculated formula	C64 H56 Ag10 N32 O41 P W12
Title of publication	A series of polyoxometalate-based compounds including infinite Ag belts and circles constructed by two tolyl-1H-tetrazole isomers
Authors of publication	Tian, Aixiang; Hou, Xue; Ying, Jun; Liu, Guocheng; Yang, Yang; Ning, Yali; Li, Tianjiao; Wang, Xiuli
Journal of publication	RSC Adv.
Year of publication	2015
a	24.98 ± 0.003 Å
b	19.327 ± 0.003 Å
c	21.407 ± 0.003 Å
α	90°
β	96.019 ± 0.002°
γ	90°
Cell volume	10278 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0899
Residual factor for significantly intense reflections	0.0428
Weighted residual factors for significantly intense reflections	0.0936
Weighted residual factors for all reflections included in the refinement	0.1084
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7220593.cif
137572	2015-05-30	cif/ Adding structures of 7220591, 7220592, 7220593 via cif-deposit CGI script.	7220593.cif