Crystallography Open Database

Information card for entry 7200659

7200658 << 7200659 >> 7200660

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Coordinates	7200659.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H30 N4 O11 Zn3
Calculated formula	C52 H34 N4 O11 Zn3
Title of publication	Highly tunable metal‒organic frameworks with open metal centers
Authors of publication	Choi, Eun-Young; Wray, Curtis A.; Hu, Chunhua; Choe, Wonyoung
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	4
Pages of publication	553
a	16.694 ± 0.001 Å
b	16.694 ± 0.001 Å
c	18.5799 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	5178 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	139
Hermann-Mauguin space group symbol	I 4/m m m
Hall space group symbol	-I 4 2
Residual factor for all reflections	0.0647
Residual factor for significantly intense reflections	0.0481
Weighted residual factors for significantly intense reflections	0.1283
Weighted residual factors for all reflections included in the refinement	0.1373
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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