Information card for entry 4323011

Structure parameters

• Formula: C34 H40 Cl2 N2 Ni O10 P2 S4
• Calculated formula: C34 H40 Cl2 N2 Ni O10 P2 S4
• Title of publication: Synthesis and Reactivity of Nickel(II) Complexes of the Pyridine-Based Phosphorus-Containing Macrocycle 6-Phenyl-15-aza-6-phospha-3,9- dithiabicyclo[9,3,1]pentadeca-1(15),11,13-triene
• Authors of publication: Lluis Escriche; José Antonio Muñoz; Joan Rosell; Raikko Kivekäs; Reijo Sillanpää; Jaume Casabó
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 4807 - 4813
• a: 10.564 ± 0.001 Å
• b: 11.975 ± 0.002 Å
• c: 9.124 ± 0.002 Å
• α: 109.79 ± 0.01°
• β: 95.67 ± 0.02°
• γ: 109.19 ± 0.01°
• Cell volume: 996.6 ± 0.3 ų
• Cell temperature: 294 K
• Ambient diffraction temperature: 294 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.067
• Goodness-of-fit parameter for significantly intense reflections: 1.576
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No