Crystallography Open Database

Information card for entry 4325029

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Coordinates	4325029.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H96 Cu3 F12 N8 O16
Calculated formula	C73 H96 Cu3 F12 N8 O16
Title of publication	"Jumping Crystals": Oxygen-Evolving Metal-Nitroxide Complexes
Authors of publication	Victor I. Ovcharenko; Sergei V. Fokin; Elena Yu. Fursova; Olga V. Kuznetsova; Eugene V. Tretyakov; Galina V. Romanenko; Artem S. Bogomyakov
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	4307 - 4312
a	13.211 ± 0.006 Å
b	13.484 ± 0.006 Å
c	14.439 ± 0.006 Å
α	65.853 ± 0.009°
β	77.863 ± 0.009°
γ	65.048 ± 0.009°
Cell volume	2125.8 ± 1.6 Å³
Cell temperature	293 ± 1 K
Ambient diffraction temperature	293 ± 1 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	0.1202
Residual factor for significantly intense reflections	0.065
Weighted residual factors for significantly intense reflections	0.1295
Weighted residual factors for all reflections included in the refinement	0.1471
Goodness-of-fit parameter for all reflections included in the refinement	0.939
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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