Information card for entry 4313178

Structure parameters

• Formula: C19 H19 Cu N3 O5 S
• Calculated formula: C15.5 H16.5 Cu0.5 N2.5 O4 S0.5
• Title of publication: Structural Modulation of Cu(I) and Cu(II) Complexes of Sterically Hindered Tripyridine Ligands by the Bridgehead Alkyl Groups
• Authors of publication: Masahito Kodera; Yuuji Kajita; Yoshimitsu Tachi; Koji Kano
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 1193 - 1203
• a: 8.422 ± 0.003 Å
• b: 18.193 ± 0.003 Å
• c: 13.876 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2126.1 ± 1 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 6
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for all reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections: 1.539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.54
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No