Information card for entry 2202769

Structure parameters

• Chemical name: (R,R,R,R)10,21-Di-tert-butyl-4,5,15,16-tetraphenyl-3,6,14,17-tetraaza -tricyclo[17.3.1.18,12]tetracosa-1(23),2,6,8,10,12(24),13,17, 19,21-decaene-23,24-diol ethane-1,2-diol dinuclear Nickel(II) diperchlorate bishydrate complex
• Formula: C54 H60 Cl2 N4 Ni2 O14
• Calculated formula: C54 H60 Cl2 N4 Ni2 O14
• Title of publication: [μ-10,21-Di-<i>tert</i>-butyl-4(<i>S</i>),5(<i>S</i>),15(<i>S</i>),16(<i>S</i>)-tetraphenyl-3,6,14,17-tetraazatricyclo[17.3.1.18,12]tetracosa-1(23),2,6,8,10,12(24),13,17,19,21-decaene-23,24-diolato](μ-ethylene glycol)dinickel(II) diperchlorate dihydrate
• Authors of publication: Wu, Jin-Cai; Li, Yi-Zhi; Tang, Ling; Tan, Min-Yu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 7
• Pages of publication: m494 - m496
• a: 11.536 ± 0.003 Å
• b: 11.536 ± 0.003 Å
• c: 43.015 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5724 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0496
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1583
• Weighted residual factors for all reflections included in the refinement: 0.159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes