Information card for entry 2231242

Structure parameters

• Chemical name: [Bis(pyridin-2-ylmethyl) ether]trichloridorhodium(III) dichloromethane monosolvate
• Formula: C13 H14 Cl5 N2 O Rh
• Calculated formula: C13 H14 Cl5 N2 O Rh
• SMILES: c12cccc[n]2[Rh]2([n]3c(C[O]2C1)cccc3)(Cl)(Cl)Cl.C(Cl)Cl
• Title of publication: [Bis(pyridin-2-ylmethyl) ether]trichloridorhodium(III) dichloromethane monosolvate: unusual hydrolysis of the methylene bridge in (pyrazolylmethyl)pyridine
• Authors of publication: Ojwach, Stephen O.; Omondi, Bernard; Darkwa, James
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: m1097
• a: 9.536 ± 0.0018 Å
• b: 12.527 ± 0.002 Å
• c: 14.34 ± 0.003 Å
• α: 90°
• β: 95.071 ± 0.004°
• γ: 90°
• Cell volume: 1706.3 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.09
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.114
• Weighted residual factors for all reflections included in the refinement: 0.1392
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes