Crystallography Open Database

Information card for entry 7213045

Preview

Coordinates	7213045.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cu1.5 H Mo O5
Calculated formula	Cu1.5 H Mo O5
Title of publication	Hydrothermal assembly and crystal structures of three novel open frameworks based on molybdenum(vi) oxides
Authors of publication	Xu, Yan; Lu, Jianjiang; Goh, Ngoh K.
Journal of publication	Journal of Materials Chemistry
Year of publication	1999
Journal volume	9
Journal issue	7
Pages of publication	1599
a	5.358 ± 0.006 Å
b	5.574 ± 0.015 Å
c	7.632 ± 0.006 Å
α	103.74 ± 0.15°
β	106.25 ± 0.09°
γ	97.37 ± 0.23°
Cell volume	207.9 ± 0.7 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0295
Residual factor for significantly intense reflections	0.025
Weighted residual factors for all reflections	0.0721
Weighted residual factors for significantly intense reflections	0.0645
Goodness-of-fit parameter for all reflections	1.067
Goodness-of-fit parameter for significantly intense reflections	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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