Information card for entry 7031664

Structure parameters

• Formula: C78 H88 Cu3 N22 S6
• Calculated formula: C78 H88 Cu3 N22 S6
• Title of publication: Two new coordination polymers, a trinuclear metal complex and their interconversion depending on the solvent.
• Authors of publication: Koike, Shiori; Hirakawa, Takeshi; Yamanishi, Katsunori; Kondo, Mitsuru
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 34
• Pages of publication: 12832
• a: 33.693 ± 0.003 Å
• b: 15.1759 ± 0.0016 Å
• c: 15.8193 ± 0.0014 Å
• α: 90°
• β: 92.281 ± 0.004°
• γ: 90°
• Cell volume: 8082.3 ± 1.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for all reflections included in the refinement: 0.1271
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No