Information card for entry 4322890

Structure parameters

• Formula: C14 H28 Cu N6 O5
• Calculated formula: C224 H288 Cu16 N96 O80
• Title of publication: Zigzag-Chain and Cyclic-Tetrameric Compounds Derived by Deprotonation of Mononuclear Copper(II) Complexes with N,N'-Bis(2-substituted-imidazol-4-ylmethyl- idene)-1,4-diaminobutane (2-Substituent = H, Me): Synthesis, Characterization, Structure, Substituent Effect, and Interconvertibility
• Authors of publication: Masaaki Mimura; Toshihiro Matsuo; Toshio Nakashima; Naohide Matsumoto
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 3553 - 3560
• a: 23.114 ± 0.003 Å
• b: 23.1144 Å
• c: 14.973 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8000 ± 3 ų
• Cell temperature: 20 K
• Ambient diffraction temperature: 20 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.03
• Goodness-of-fit parameter for significantly intense reflections: 2.09
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No