Crystallography Open Database

Information card for entry 7057992

Preview

Coordinates	7057992.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H50 F2 N2 Ni3 O26 P4
Calculated formula	C18 H50 F2 N2 Ni3 O26 P4
Title of publication	A water-stable Ni(ii) diphosphonate exhibiting water vapor adsorption and water-assisted high proton conductivity
Authors of publication	Xu, Hailong; Feng, Lu; Huang, Wentao; Wang, Qiaoyun; Zhou, Hong
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	2
Pages of publication	807
a	19.126 ± 0.002 Å
b	6.2821 ± 0.0006 Å
c	15.7341 ± 0.0018 Å
α	90°
β	106.417 ± 0.004°
γ	90°
Cell volume	1813.4 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0994
Residual factor for significantly intense reflections	0.0488
Weighted residual factors for significantly intense reflections	0.0799
Weighted residual factors for all reflections included in the refinement	0.0929
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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