Crystallography Open Database

Information card for entry 7718067

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Coordinates	7718067.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	K2 Mo5 O22 P2 Rb2
Calculated formula	K2 Mo5 O22 P2 Rb2
Title of publication	Four noncentrosymmetric molybdophosphates discovered by a chemical substitution strategy.
Authors of publication	Gao, Zhixia; Li, Ke; Du, Hong; Baiheti, Tuohetijiang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	10
Pages of publication	4025 - 4029
a	6.4888 ± 0.0006 Å
b	19.224 ± 0.0014 Å
c	17.3168 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	2160.1 ± 0.3 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	5
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.0389
Residual factor for significantly intense reflections	0.0339
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.0736
Goodness-of-fit parameter for all reflections included in the refinement	1.004
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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