Information card for entry 4066348

Structure parameters

• Formula: C27 H41 Rh
• Calculated formula: C27 H41 Rh
• SMILES: [Rh]123456([c]7([c]4([c]3([c]2([c]17C)C)C)c1cc(cc(c1)C(C)(C)C)C(C)(C)C)C)([CH2]=[CH2]5)[CH2]=[CH2]6
• Title of publication: Synthesis of Rhodium Complexes with Bulky Substituted Cyclopentadienyl Ligands. H/D Exchange Reactions and Silane Activation†
• Authors of publication: Esqueda, Ana Cristina; Conejero, Salvador; Maya, Celia; Carmona, Ernesto
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 21
• Pages of publication: 5481
• a: 9.2708 ± 0.0002 Å
• b: 23.2398 ± 0.0004 Å
• c: 11.5998 ± 0.0002 Å
• α: 90°
• β: 96.688 ± 0.001°
• γ: 90°
• Cell volume: 2482.19 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0173
• Residual factor for significantly intense reflections: 0.0169
• Weighted residual factors for significantly intense reflections: 0.0404
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No