Information card for entry 4350383

Structure parameters

• Common name: Complex 5a (Perez), [(Tp4’Py,Me)2Zn][Tp4‘Py,MeZn-OH]2
• Chemical name: Bis ( hydrotris ( 3-( 4‘-pyridyl )-5-methyl )pyrazolylborate )-zinc-bis
• Formula: C55.5 H53 B2 Cl3.5 N18 O2 Zn1.5
• Calculated formula: C55.5 H53 B2 Cl3.5 N18 O2 Zn1.5
• Title of publication: Zn-OH2 and Zn-OH complexes with hydroborate-derived tripod ligands: a comprehensive study.
• Authors of publication: Ibrahim, Mohamed M.; Olmo, Cristina Pérez; Tekeste, Teame; Seebacher, Jan; He, Guosen; Maldonado Calvo, José A; Böhmerle, Karin; Steinfeld, Gunther; Brombacher, Horst; Vahrenkamp, Heinrich
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 18
• Pages of publication: 7493 - 7502
• a: 20.566 ± 0.003 Å
• b: 16.961 ± 0.003 Å
• c: 33.994 ± 0.005 Å
• α: 90°
• β: 92.157 ± 0.004°
• γ: 90°
• Cell volume: 11849 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1429
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.1717
• Weighted residual factors for all reflections included in the refinement: 0.2109
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No