Information card for entry 7001951

Structure parameters

• Formula: C25 H42 I N2 O2 P
• Calculated formula: C25 H42 I N2 O2 P
• Title of publication: Unprecedented cubane-type silver cluster with a novel phosphinite functionalized N-heterocyclic carbene ligand
• Authors of publication: Raynal, Matthieu; Liu, Xianghao; Pattacini, Roberto; Vallée, Christophe; Olivier-Bourbigou, Hélène; Braunstein, Pierre
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 35
• Pages of publication: 7288
• a: 30.511 ± 0.002 Å
• b: 12.0084 ± 0.001 Å
• c: 16.9043 ± 0.0007 Å
• α: 90°
• β: 112.949 ± 0.003°
• γ: 90°
• Cell volume: 5703.3 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1356
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1321
• Weighted residual factors for all reflections included in the refinement: 0.1629
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No