Information card for entry 7200961

Structure parameters

• Common name: Polymeric tetra-mu-acetato-diaqua-tris(4,4- bipyridyl)trizinc(ii) bis(hexafluorophosphate)monohydrate
• Formula: C38 H44 F12 N6 O12 P2 Zn3
• Calculated formula: C38 H40 F12 N6 O12 P2 Zn3
• Title of publication: Drastic steric effects from, respectively, a hydrogen, a methyl and an ethyl group on the coordination network of a zinc(II)‒4,4′-bipyridine‒carboxylato ternary system
• Authors of publication: Phuengphai, Pongthipun; Youngme, Sujittra; Kongsaeree, Palangpon; Pakawatchai, Chaveng; Chaichit, Narongsak; Teat, Simon J.; Gamez, Patrick; Reedijk, Jan
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 8
• Pages of publication: 1723
• a: 10.6952 ± 0.0007 Å
• b: 11.4831 ± 0.0007 Å
• c: 11.7638 ± 0.0007 Å
• α: 101.558 ± 0.002°
• β: 116.757 ± 0.002°
• γ: 95.574 ± 0.002°
• Cell volume: 1234.58 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0895
• Residual factor for significantly intense reflections: 0.0648
• Weighted residual factors for significantly intense reflections: 0.1666
• Weighted residual factors for all reflections included in the refinement: 0.1867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No