Crystallography Open Database

Information card for entry 7038109

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Coordinates	7038109.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H28 Cu3 N2 O13
Calculated formula	C46 H28 Cu3 N2 O13
Title of publication	A porous metal-organic framework with a unique hendecahedron-shaped cage: structure and controlled drug release.
Authors of publication	Wei, Lian-Qiang; Chen, Qing; Tang, Li-Le; Zhuang, Chong; Zhu, Wen-Run; Lin, Ning
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	9
Pages of publication	3694 - 3697
a	19.259 ± 0.0002 Å
b	19.259 ± 0.0002 Å
c	61.2256 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	22709.1 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	141
Hermann-Mauguin space group symbol	I 41/a m d :2
Hall space group symbol	-I 4bd 2
Residual factor for all reflections	0.0456
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.1474
Weighted residual factors for all reflections included in the refinement	0.1497
Goodness-of-fit parameter for all reflections included in the refinement	1.131
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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