Crystallography Open Database

Information card for entry 4306738

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Coordinates	4306738.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C116 H148 Cl2 N56 Ni14 O42
Calculated formula	C96 H84 N56 Ni14 O22
Title of publication	Unusual Structural Types in Nickel Cluster Chemistry from the Use of Pyridyl Oximes: Ni5, Ni12Na2, and Ni14 Clusters
Authors of publication	Theocharis C. Stamatatos; Albert Escuer; Khalil A. Abboud; Catherine P. Raptopoulou; Spyros P. Perlepes; George Christou
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	11825 - 11838
a	17.143 ± 0.006 Å
b	20.214 ± 0.007 Å
c	25.715 ± 0.009 Å
α	83.379 ± 0.007°
β	82.208 ± 0.007°
γ	65.901 ± 0.008°
Cell volume	8041 ± 5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2199
Residual factor for significantly intense reflections	0.0828
Weighted residual factors for significantly intense reflections	0.1813
Weighted residual factors for all reflections included in the refinement	0.2042
Goodness-of-fit parameter for all reflections included in the refinement	0.603
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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