Information card for entry 8107648

Structure parameters

• Formula: C52 H72 N8 Ni2 O20 S4
• Calculated formula: C52 H72 N8 Ni2 O20 S4
• Title of publication: Crystal structure of catena[(tetraaqua-bis(μ2-(4,4'-bipyridine-κ2N:N'))- nickel(II)][(diaqua-bis(3-methyl-4-amino-benzensulphonate-κ1O)-bis(μ2- (4,4'-bipyridine-κ2N:N'))nickel(II)]—3-methyl-4-aminobenzensulphonate— ethanol (1:2:2), C52H72N8Ni2O20S4
• Authors of publication: Han, Min-Le; Du, De-Guang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2015
• Journal volume: 230
• Journal issue: 1
• Pages of publication: 41 - 43
• a: 14.604 ± 0.001 Å
• b: 18.865 ± 0.002 Å
• c: 11.0673 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3049.1 ± 0.5 ų
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0727
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No