Crystallography Open Database

Information card for entry 4103551

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Coordinates	4103551.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H12 O13 Zn4
Calculated formula	C24 H12 O13 Zn4
Title of publication	Chromatography in a Single Metal-Organic Framework (MOF) Crystal
Authors of publication	Shuangbing Han; Yanhu Wei; Cory Valente; István Lagzi; Jeremiah J. Gassensmith; Ali Coskun; J. Fraser Stoddart; Bartosz A. Grzybowski
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	16358 - 16361
a	25.6572 ± 0.0005 Å
b	25.6572 ± 0.0005 Å
c	25.6572 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	16889.9 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.0669
Residual factor for significantly intense reflections	0.0469
Weighted residual factors for significantly intense reflections	0.1516
Weighted residual factors for all reflections included in the refinement	0.1582
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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