Information card for entry 4072164

Structure parameters

• Chemical name: Tetrakis-μ-(valerolactamate)-bis(hydrate)dirhodium(II,III) tetrafluoroborate
• Formula: C20 H36 B F4 N4 O6 Rh2
• Calculated formula: C20 H36 B F4 N4 O6 Rh2
• Title of publication: Removal of Metal−Metal Bonding in a Dimetallic Paddlewheel Complex: Molecular and Electronic Structure of Bis(phenyl) Dirhodium(III) Carboxamidate Compounds
• Authors of publication: Wolf, Joffrey; Poli, Rinaldo; Xie, Jian-Hua; Nichols, Jason; Xi, Bin; Zavalij, Peter; Doyle, Michael P.
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 22
• Pages of publication: 5836
• a: 12.4694 ± 0.0006 Å
• b: 17.4131 ± 0.0008 Å
• c: 13.4049 ± 0.0006 Å
• α: 90°
• β: 110.823 ± 0.001°
• γ: 90°
• Cell volume: 2720.5 ± 0.2 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 7
• 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: 0.0294
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No