Information card for entry 1545920

Structure parameters

• Formula: C181 H119 Cl15 N16 O22 P6 Zr4
• Calculated formula: C181 H119 Cl15 N16 O22 P6 Zr4
• Title of publication: Triphosphate Ion-Selective Electrode Based on Zr-Porphyrin Complex.
• Authors of publication: Yagi, Yuma; Masaki, Shuhei; Iwata, Tetsuki; Nakane, Daisuke; Yasui, Takashi; Yuchi, Akio
• Journal of publication: Analytical chemistry
• Year of publication: 2017
• Journal volume: 89
• Journal issue: 7
• Pages of publication: 3937 - 3942
• a: 15.402 ± 0.004 Å
• b: 17.812 ± 0.004 Å
• c: 18.047 ± 0.005 Å
• α: 87.569 ± 0.006°
• β: 85.646 ± 0.005°
• γ: 71.376 ± 0.005°
• Cell volume: 4677 ± 2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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 significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.2925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.609
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No