Crystallography Open Database

Information card for entry 7251708

Preview

Coordinates	7251708.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H30 Ni O18 S2
Calculated formula	C2 H29.9994 Ni O18 S2
Title of publication	Phase equilibria and thermodynamic properties of the nickel(II) methanesulfonate-methanesulfonic acid-water system.
Authors of publication	Derison, Femke; Jia, Xu; Van Meervelt, Luc; Binnemans, Koen; Lommelen, Rayco
Journal of publication	Physical chemistry chemical physics : PCCP
Year of publication	2026
Journal volume	28
Journal issue	5
Pages of publication	3401 - 3414
a	9.2073 ± 0.0004 Å
b	9.2073 ± 0.0004 Å
c	21.4213 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	1572.68 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0299
Residual factor for significantly intense reflections	0.0259
Weighted residual factors for significantly intense reflections	0.0614
Weighted residual factors for all reflections included in the refinement	0.0635
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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