Crystallography Open Database

Information card for entry 7248212

Preview

Coordinates	7248212.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C120 H163 Ag2 N34 O50 P S16 W12
Calculated formula	C112 H145 Ag2 N32 O48 P S16 W12
Title of publication	Highly efficient photoelectrocatalytic oxidation of arsenic(iii) with a polyoxometalate-thiacalix[4]arene-based metal–organic complex-modified bismuth vanadate photoanode
Authors of publication	Song, Yuting; Zhang, Jia-Yi; Yang, Jin; Bo, Tao; Ma, Jian-Fang
Journal of publication	Green Chemistry
Year of publication	2024
Journal volume	26
Journal issue	7
Pages of publication	3874 - 3883
a	12.6937 ± 0.0006 Å
b	18.449 ± 0.0008 Å
c	19.5975 ± 0.0007 Å
α	75.711 ± 0.004°
β	77.491 ± 0.004°
γ	88.11 ± 0.004°
Cell volume	4340.9 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0969
Residual factor for significantly intense reflections	0.0556
Weighted residual factors for significantly intense reflections	0.1062
Weighted residual factors for all reflections included in the refinement	0.1277
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
291002 (current)	2024-04-05	cif/ Updating files of 7248212 Original log message: Adding full bibliography for 7248212.cif.	7248212.cif
289932	2024-02-23	cif/ Adding structures of 7248212 via cif-deposit CGI script.	7248212.cif