Information card for entry 4338167

Structure parameters

• Formula: C71 H65 B F3 N13 O5 S W2
• Calculated formula: C71 H65 B F3 N13 O5 S W2
• Title of publication: Oxidative stretching of metal-metal bonds to their limits.
• Authors of publication: Brogden, David W.; Turov, Yevgeniya; Nippe, Michael; Li Manni, Giovanni; Hillard, Elizabeth A.; Clérac, Rodolphe; Gagliardi, Laura; Berry, John F.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 4777 - 4790
• a: 14.0857 ± 0.0006 Å
• b: 15.7157 ± 0.0006 Å
• c: 16.9784 ± 0.0007 Å
• α: 71.752 ± 0.002°
• β: 69.914 ± 0.002°
• γ: 77.51 ± 0.002°
• Cell volume: 3327.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0515
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1318
• Weighted residual factors for all reflections included in the refinement: 0.1337
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No