Information card for entry 4306174

Structure parameters

• Formula: C19.82 H18.65 Cl3.64 Cu N9
• Calculated formula: C19.823 H18.646 Cl3.646 Cu N9
• Title of publication: First-Row Transition-Metal Complexes of a New Pentadentate Ligand, α,α,α',α'-Tetra(pyrazolyl)lutidine
• Authors of publication: Tyler J. Morin; Brian Bennett; Sergey V. Lindeman; James R. Gardinier
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 7468 - 7470
• a: 10.8339 ± 0.0002 Å
• b: 22.2728 ± 0.0003 Å
• c: 9.8029 ± 0.0001 Å
• α: 90°
• β: 92.995 ± 0.001°
• γ: 90°
• Cell volume: 2362.22 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.041
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0745
• Weighted residual factors for all reflections included in the refinement: 0.0792
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No