Information card for entry 7234412

Structure parameters

• Chemical name: catena-(dodecakis(μ~2~-cyano)-dodecacyano- hexakis(bis(3-aminopropyl)amine)-hexa- copper(II)-tri-molybdenum(IV) water solvate)
• Formula: C60 H118 Cu6 Mo3 N42 O8
• Calculated formula: C60 H118 Cu6 Mo3 N42 O8
• Title of publication: Photo-induced magnetic properties of the [CuII(bapa)]2[MoIV(CN)8].7H2O molecular ribbon
• Authors of publication: Olaf Stefanczyk; Anna M. Majcher; Michaf Rams; Wojciech Nitek; Corine Mathoniere; Barbara Sieklucka
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 8712 - 8719
• a: 15.5673 ± 0.0006 Å
• b: 16.1758 ± 0.0006 Å
• c: 24.8869 ± 0.001 Å
• α: 102.37 ± 0.002°
• β: 91.285 ± 0.002°
• γ: 115.542 ± 0.002°
• Cell volume: 5476.1 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0661
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1551
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No