Information card for entry 4505948

Structure parameters

• Formula: C18 Cu N2 O6 P2
• Calculated formula: C18 Cu N2 O6 P2
• Title of publication: Influence of π‒π Stacking Interactions on the Assembly of Layered Copper Phosphonate Coordination Polymers: Combined Powder Diffraction and Electron Paramagnetic Resonance Study
• Authors of publication: Taddei, Marco; Costantino, Ferdinando; Vivani, Riccardo; Sangregorio, Claudio; Sorace, Lorenzo; Castelli, Lisa
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 5
• Pages of publication: 2327
• a: 8.5677 ± 0.0005 Å
• b: 8.8858 ± 0.0007 Å
• c: 13.8837 ± 0.0006 Å
• α: 87.271 ± 0.006°
• β: 79.774 ± 0.004°
• γ: 65.615 ± 0.004°
• Cell volume: 947.01 ± 0.11 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• RFsqd: 0.08313
• Goodness-of-fit parameter for all reflections: 4.54
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: Kα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No