Crystallography Open Database

Information card for entry 7206334

7206333 << 7206334 >> 7206335

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Coordinates	7206334.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H60 N12 O35 Zn11
Calculated formula	C48 H60 N12 O35 Zn11
Title of publication	An unusual (3,6)-connected microporous metal‒organic framework based on tetrahedral Zn4 clusters with selective adsorption of CO2
Authors of publication	Zeng, Rong-Rong; Zhai, Quan-Guo; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	15
Pages of publication	4823
a	14.347 ± 0.0018 Å
b	14.347 ± 0.0018 Å
c	20.408 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	3637.9 ± 0.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	165
Hermann-Mauguin space group symbol	P -3 c 1
Hall space group symbol	-P 3 2"c
Residual factor for all reflections	0.1019
Residual factor for significantly intense reflections	0.0662
Weighted residual factors for significantly intense reflections	0.1703
Weighted residual factors for all reflections included in the refinement	0.192
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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