Crystallography Open Database

Information card for entry 4003010

Preview

Coordinates	4003010.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	MUF-17
Formula	C32 H38 Co5 N4 O26
Calculated formula	C32 H38 Co5 N4 O26
Title of publication	Multipurpose Metal‒Organic Framework for the Adsorption of Acetylene: Ethylene Purification and Carbon Dioxide Removal
Authors of publication	Qazvini, Omid T.; Babarao, Ravichandar; Telfer, Shane G.
Journal of publication	Chemistry of Materials
Year of publication	2019
Journal volume	31
Journal issue	13
Pages of publication	4919
a	35.4961 ± 0.0019 Å
b	11.188 ± 0.0005 Å
c	21.9119 ± 0.0016 Å
α	90°
β	94.224 ± 0.011°
γ	90°
Cell volume	8678.2 ± 0.9 Å³
Cell temperature	292.15 K
Ambient diffraction temperature	292.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.199
Residual factor for significantly intense reflections	0.1503
Weighted residual factors for significantly intense reflections	0.3628
Weighted residual factors for all reflections included in the refinement	0.4129
Goodness-of-fit parameter for all reflections included in the refinement	1.42
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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