Information card for entry 7207836

Structure parameters

• Formula: C16 H14 Cu N2 O6 P2
• Calculated formula: C16 H14 Cu N2 O6 P2
• Title of publication: New copper aryl phosphonates with auxiliary nitrogen ligands
• Authors of publication: Zima, Vítězslav; Svoboda, Jan; Yang, Ya-Ching; Wang, Sue-Lein
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 3469
• a: 9.143 ± 0.003 Å
• b: 9.4 ± 0.003 Å
• c: 11.457 ± 0.004 Å
• α: 101.379 ± 0.007°
• β: 91.586 ± 0.007°
• γ: 114.862 ± 0.006°
• Cell volume: 869 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0261
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No