Information card for entry 4502280

Structure parameters

• Formula: C15 H29 Cu N2 O9.5
• Calculated formula: C15 H20 Cu N2 O9.5
• Title of publication: Synthesis, Structure, and Magnetic Properties of Closely Related Mono- and Di-Cu(II) Schiff Base Complexes: Formation of Water Clusters and Hydrogen-Bonded Networks
• Authors of publication: Khatua, Snehadrinarayan; Kang, Jina; Huh, Jung Oh; Hong, Chang Seop; Churchill, David G.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 1
• Pages of publication: 327
• a: 7.9865 ± 0.0012 Å
• b: 10.4948 ± 0.0016 Å
• c: 13.6062 ± 0.0019 Å
• α: 75.048 ± 0.007°
• β: 84.279 ± 0.007°
• γ: 70.711 ± 0.007°
• Cell volume: 1039.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0826
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1264
• Weighted residual factors for all reflections included in the refinement: 0.1452
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No