Information card for entry 4348076

Structure parameters

• Formula: C4 Cl2 N2 O6 P2 Zr
• Calculated formula: C4 Cl2 N2 O6 P2 Zr
• Title of publication: Amino-Functionalized Layered Crystalline Zirconium Phosphonates: Synthesis, Crystal Structure, and Spectroscopic Characterization.
• Authors of publication: Taddei, Marco; Sassi, Paola; Costantino, Ferdinando; Vivani, Riccardo
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 12
• Pages of publication: 6278 - 6285
• a: 9.3484 ± 0.0008 Å
• b: 5.3938 ± 0.0004 Å
• c: 29.5926 ± 0.0012 Å
• α: 90°
• β: 102.988 ± 0.007°
• γ: 90°
• Cell volume: 1453.99 ± 0.18 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• RFsqd: 0.12327
• Goodness-of-fit parameter for all reflections: 5.25
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5405 Å
• Diffraction radiation type: Cu_Kα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No