Crystallography Open Database

Information card for entry 7248574

Preview

Coordinates	7248574.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F3 H Mn Na2 O4 P
Calculated formula	F3 H Mn Na2 O4 P
Title of publication	Synthesis and magnetic properties of two fluorophosphates K2Mn(PO3F)F3 and Na2Mn(HPO4)F3 with a S = 2 uniform spin chain structure
Authors of publication	Luo, Qi; Li, Ningxia; Zhao, Zhiying; Cui, Meiyan; He, Zhangzhen
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	21
Pages of publication	2796 - 2802
a	5.6785 ± 0.0003 Å
b	7.7011 ± 0.0003 Å
c	6.8171 ± 0.0004 Å
α	90°
β	109.673 ± 0.006°
γ	90°
Cell volume	280.72 ± 0.03 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 K
Number of distinct elements	6
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0273
Residual factor for significantly intense reflections	0.025
Weighted residual factors for significantly intense reflections	0.058
Weighted residual factors for all reflections included in the refinement	0.0593
Goodness-of-fit parameter for all reflections included in the refinement	1.121
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7248574.html