Information card for entry 7007197

Structure parameters

• Formula: C62 H62 B4 F16 N6 P4 Re2
• Calculated formula: C62 H62 B4 F16 N6 P4 Re2
• Title of publication: Syntheses and reactivity studies of solvated dirhenium acetonitrile complexes.
• Authors of publication: Bera, Jitendra K.; Schelter, Eric J.; Patra, Sanjib K.; Bacsa, John; Dunbar, Kim R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 33
• Pages of publication: 4011 - 4019
• a: 16.082 ± 0.003 Å
• b: 22.31 ± 0.005 Å
• c: 19.884 ± 0.004 Å
• α: 90°
• β: 93.58 ± 0.03°
• γ: 90°
• Cell volume: 7120 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1009
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1413
• Weighted residual factors for all reflections included in the refinement: 0.1538
• Goodness-of-fit parameter for all reflections included in the refinement: 0.974
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No