Crystallography Open Database

Information card for entry 7120220

7120219 << 7120220 >> 7120221

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Coordinates	7120220.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H32 Mo6 N6 O25 P0.5
Calculated formula	C21 H32 Mo6 N6 O25 P0.5
Title of publication	A dielectric anomaly observed for doubly reduced mixed-valence polyoxometalate
Authors of publication	Nakamura, Ippei; Tsunashima, Ryo; Nishihara, Sadafumi; Inoue, Katsuya; Akutagawa, Tomoyuki
Journal of publication	Chem. Commun.
Year of publication	2017
a	12.8074 ± 0.0002 Å
b	12.9424 ± 0.0002 Å
c	13.237 Å
α	62.519 ± 0.003°
β	79.896 ± 0.004°
γ	89.318 ± 0.004°
Cell volume	1910.38 ± 0.08 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0702
Residual factor for significantly intense reflections	0.069
Weighted residual factors for significantly intense reflections	0.2559
Weighted residual factors for all reflections included in the refinement	0.2586
Goodness-of-fit parameter for all reflections included in the refinement	2.147
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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