Crystallography Open Database

Information card for entry 4348927

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Coordinates	4348927.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C159 H210 N13 O21 Zn7
Calculated formula	C159 H210 N13 O21 Zn7
Title of publication	Triple-Stranded Cluster Helicates for the Selective Catalytic Oxidation of C-H Bonds.
Authors of publication	Fang, Yu; Gong, Wei; Liu, Lujia; Liu, Yan; Cui, Yong
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	20
Pages of publication	10102 - 10105
a	20.7405 ± 0.0004 Å
b	24.232 ± 0.0005 Å
c	32.6921 ± 0.0005 Å
α	90°
β	97.999 ± 0.001°
γ	90°
Cell volume	16270.7 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0652
Residual factor for significantly intense reflections	0.0558
Weighted residual factors for significantly intense reflections	0.1536
Weighted residual factors for all reflections included in the refinement	0.1685
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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