Information card for entry 4128748

Structure parameters

• Common name: ZIF-4-cp-II
• Chemical name: catena-(tetrakis(μ2-Imidazolato-N,N')-di-zinc(ii) clathrate)
• Formula: C6 H6 N4 Zn
• Calculated formula: C6 H6 N4 Zn
• Title of publication: Rich Polymorphism of a Metal-Organic Framework in Pressure-Temperature Space.
• Authors of publication: Widmer, Remo N.; Lampronti, Giulio I.; Chibani, Siwar; Wilson, Craig W.; Anzellini, Simone; Farsang, Stefan; Kleppe, Annette K.; Casati, Nicola P. M.; MacLeod, Simon G.; Redfern, Simon A. T.; Coudert, François-Xavier; Bennett, Thomas D.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 23
• Pages of publication: 9330 - 9337
• a: 14.56659 Å
• b: 14.44478 Å
• c: 15.45102 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3251.07 ų
• Cell temperature: 313 K
• Ambient diffraction temperature: 313 K
• Ambient diffracton pressure: 200000 kPa
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0627
• Goodness-of-fit parameter for all reflections: 23.634
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.4246 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No