Information card for entry 7012042

Structure parameters

• Formula: C36 H36 Cu N8 O3 S
• Calculated formula: C36 H36 Cu N8 O3 S
• Title of publication: A comparative investigation of supramolecular structures involving copper(ii) complexes of imidazolinylalkanimidamides
• Authors of publication: Bishop, Michael M.; Lindoy, Leonard F.; Miller, Daniel J.; Turner, Peter
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 22
• Pages of publication: 4128
• a: 11.3898 ± 0.0015 Å
• b: 14.843 ± 0.002 Å
• c: 40.196 ± 0.005 Å
• α: 90°
• β: 95.298 ± 0.002°
• γ: 90°
• Cell volume: 6766.5 ± 1.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0946
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1057
• Weighted residual factors for all reflections included in the refinement: 0.1201
• Goodness-of-fit parameter for all reflections included in the refinement: 1.261
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No