Information card for entry 7115105

Structure parameters

• Chemical name: zinc phosphonate-aminobutyrate
• Formula: C4 H8 N O5 P Zn
• Calculated formula: C4 H8 N O5 P Zn
• Title of publication: Frameworks of amino acids: synthesis and characterization of two zinc phosphono-amino-carboxylates with extended structures
• Authors of publication: Hartman, Stacy J.; Todorov, Evgeny; Cruz, Carlos; Sevov, Slavi C.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 13
• Pages of publication: 1213
• a: 5.2022 ± 0.0006 Å
• b: 35 ± 0.003 Å
• c: 8.1165 ± 0.0004 Å
• α: 90°
• β: 94.156 ± 0.015°
• γ: 90°
• Cell volume: 1473.9 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2714
• Residual factor for significantly intense reflections: 0.0845
• Weighted residual factors for significantly intense reflections: 0.1596
• Weighted residual factors for all reflections included in the refinement: 0.2129
• Goodness-of-fit parameter for all reflections included in the refinement: 0.835
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No