Information card for entry 7104273

Structure parameters

• Formula: C75 H56 Cl6 Cu5 F12 N24 O P2
• Calculated formula: C75 H56 Cl5.996 Cu5 F12 N24 O P2
• Title of publication: Dynamic structural changes of pentacopper(II) chains supported by N6-donor ligands.
• Authors of publication: Takemura, Yukie; Nakajima, Takayuki; Tanase, Tomoaki; Usuki, Miho; Takenaka, Hiroe; Goto, Eri; Mikuriya, Masahiro
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 13
• Pages of publication: 1664 - 1666
• a: 15.941 ± 0.004 Å
• b: 16.059 ± 0.006 Å
• c: 18.121 ± 0.005 Å
• α: 89.268 ± 0.014°
• β: 75.493 ± 0.014°
• γ: 65.144 ± 0.008°
• Cell volume: 4052 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1039
• Residual factor for significantly intense reflections: 0.0984
• Weighted residual factors for significantly intense reflections: 0.2214
• Weighted residual factors for all reflections included in the refinement: 0.2308
• Goodness-of-fit parameter for all reflections included in the refinement: 0.957
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No