Information card for entry 2227082

Structure parameters

• Chemical name: Poly[{μ-[(phosphonomethyl)iminodimethylene]diphosphonato}dithallium(I)]
• Formula: C3 H10 N O9 P3 Tl2
• Calculated formula: C3 H10 N O9 P3 Tl2
• Title of publication: Poly[{μ~10~-[(phosphonomethyl)iminodimethylene]diphosphonato}dithallium(I)]
• Authors of publication: Gholivand, Khodayar; Farrokhi, Ali Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: m873
• a: 7.9236 ± 0.0006 Å
• b: 8.0932 ± 0.0006 Å
• c: 10.9136 ± 0.0008 Å
• α: 81.422 ± 0.001°
• β: 79.023 ± 0.001°
• γ: 68.085 ± 0.001°
• Cell volume: 635.06 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0297
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for significantly intense reflections: 0.0534
• Weighted residual factors for all reflections included in the refinement: 0.0552
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes