Crystallography Open Database

Information card for entry 4129302

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Coordinates	4129302.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C115 H154 O13 Zn4
Calculated formula	C75 H74 O13 Zn4
Title of publication	Systematic ligand modulation enhances the moisture stability and gas sorption characteristics of quaternary metal-organic frameworks.
Authors of publication	Liu, Lujia; Telfer, Shane G.
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	11
Pages of publication	3901 - 3909
a	29.8116 ± 0.0015 Å
b	29.8116 ± 0.0015 Å
c	29.8116 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	26495 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	200
Hermann-Mauguin space group symbol	P m -3
Hall space group symbol	-P 2 2 3
Residual factor for all reflections	0.0964
Residual factor for significantly intense reflections	0.0803
Weighted residual factors for significantly intense reflections	0.2579
Weighted residual factors for all reflections included in the refinement	0.2756
Goodness-of-fit parameter for all reflections included in the refinement	1.104
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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