Information card for entry 2021592

Structure parameters

• Chemical name: Bis[μ-(<i>E</i>)-2-({[3-(diethylamino)propyl]imino}methyl)phenolato]-κ^4^<i>N</i>,<i>N</i>',<i>O</i>:<i>O</i>;κ^4^<i>O</i>:<i>N</i>,<i>N</i>',<i>O</i>-(μ-2-methylbenzoato-κ^2^<i>O</i>:<i>O</i>')copper(II) perchlorate
• Formula: C32 H41 Cl Cu2 N4 O8
• Calculated formula: C32 H41 Cl Cu2 N4 O8
• Title of publication: The crystal and molecular structures of three copper-containing complexes and their activities in mimicking galactose oxidase
• Authors of publication: Dimeska, Roza; Wikaira, Jan; Mockler, Garry M.; Butcher, Ray J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 5
• Pages of publication: 538 - 544
• a: 10.51085 ± 0.00016 Å
• b: 22.2419 ± 0.0005 Å
• c: 28.8403 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6742.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.12
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes