Crystallography Open Database

Information card for entry 7041399

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Coordinates	7041399.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H24 N12 O16 Zn5
Calculated formula	C40 H24 N12 O16 Zn5
Title of publication	Microporous rod metal-organic frameworks with diverse Zn/Cd-triazolate ribbons as secondary building units for CO2 uptake and selective adsorption of hydrocarbons.
Authors of publication	Zhang, Jian-Wei; Hu, Man-Cheng; Li, Shu-Ni; Jiang, Yu-Cheng; Zhai, Quan-Guo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2017
Journal volume	46
Journal issue	3
Pages of publication	836 - 844
a	9.477 ± 0.0008 Å
b	34.8 ± 0.003 Å
c	25.01 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	8248.3 ± 1.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	74
Hermann-Mauguin space group symbol	I m m a
Hall space group symbol	-I 2b 2
Residual factor for all reflections	0.1637
Residual factor for significantly intense reflections	0.0648
Weighted residual factors for significantly intense reflections	0.1446
Weighted residual factors for all reflections included in the refinement	0.1541
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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