Crystallography Open Database

Information card for entry 1566069

Preview

Coordinates	1566069.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Potassium [poly-bis(η2-peroxido)oxido-μ-(1-oxo-κO-pyridine-4-carboxylate-κO)]molybdate(VI) hydrate
Formula	C6 H4 K Mo N O9
Calculated formula	C6 H4 K Mo N O9
Title of publication	Synthesis, crystal structure and selected properties of two new peroxidomolybdates
Authors of publication	Sławińska, Adrianna; Serda, Paweł; Oszajca, Marcin; Pamin, Katarzyna; Połtowicz, Jan; Łasocha, Wiesław
Journal of publication	Polyhedron
Year of publication	2020
Journal volume	183
Pages of publication	114530
a	9.2477 ± 0.0003 Å
b	19.5475 ± 0.0005 Å
c	6.9631 ± 0.0002 Å
α	90°
β	111.311 ± 0.003°
γ	90°
Cell volume	1172.65 ± 0.06 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	6
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	0.0659
Residual factor for significantly intense reflections	0.0644
Weighted residual factors for all reflections	0.0784
Weighted residual factors for significantly intense reflections	0.0782
Goodness-of-fit parameter for all reflections	3.59
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
272159 (current)	2022-01-20	cif/ Adding structures of 1566069, 1566070 via cif-deposit CGI script.	1566069.cif