Crystallography Open Database

Information card for entry 4311936

4311935 << 4311936 >> 4311937

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Structure parameters

Formula	C76 H94 Cl4 Cu8 N22 O28
Calculated formula	C76 H94 Cl4 Cu8 N22 O28
Title of publication	Supramolecular Copper Hydroxide Tennis Balls: Self-Assembly, Structures, and Magnetic Properties of Octanuclear [Cu8L8(OH)4]4+ Clusters (HL =N-(2-Pyridylmethyl)acetamide)
Authors of publication	Arunendu Mondal; Yang Li; Masood A. Khan; Joseph H. Ross,; Robert P. Houser
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	7075 - 7082
a	15.385 ± 0.006 Å
b	16.236 ± 0.006 Å
c	23.227 ± 0.009 Å
α	71.041 ± 0.006°
β	75.739 ± 0.006°
γ	63.633 ± 0.006°
Cell volume	4881 ± 3 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.0764
Residual factor for significantly intense reflections	0.0479
Weighted residual factors for significantly intense reflections	0.1142
Weighted residual factors for all reflections included in the refinement	0.129
Goodness-of-fit parameter for all reflections included in the refinement	0.947
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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