Information card for entry 4332940

Structure parameters

• Formula: C24 H76 Cu2 N6 O30 P2
• Calculated formula: C24 H52 Cu2 N6 O26.962 P2
• Title of publication: Cu2{[18]ane-N6} Complexes: Structures, Magnetism, and Phosphate Monoester Binding
• Authors of publication: Barker, Julia E.; Liu, Yu; Yee, Gordon T.; Chen, Wei-Zhong; Wang, Guangbin; Rivera, Vilma M.; Ren, Tong
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 7973 - 7980
• a: 14.451 ± 0.0009 Å
• b: 14.451 ± 0.0009 Å
• c: 20.6514 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3734.9 ± 0.5 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 6
• Space group number: 144
• Hermann-Mauguin space group symbol: P 31
• Hall space group symbol: P 31
• Residual factor for all reflections: 0.0976
• Residual factor for significantly intense reflections: 0.0725
• Weighted residual factors for significantly intense reflections: 0.1802
• Weighted residual factors for all reflections included in the refinement: 0.1957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No