Information card for entry 7020339

Structure parameters

• Common name: (((PhthalOH)In(H2O))ClO4)N
• Formula: C18 H26 Cl In N2 O20 P2
• Calculated formula: C18 H26 Cl In N2 O20 P2
• Title of publication: Synthesis and structures of a pentanuclear Al(III) phosphonate cage, an In(III) phosphonate polymer, and coordination compounds of the corresponding phosphonate ester with GaI3 and InCl3.
• Authors of publication: Richards, Anne F.; Beavers, Christine M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 37
• Pages of publication: 11305 - 11310
• a: 4.9622 ± 0.0002 Å
• b: 10.0472 ± 0.0004 Å
• c: 14.4552 ± 0.0006 Å
• α: 75.595 ± 0.004°
• β: 87.678 ± 0.003°
• γ: 89.821 ± 0.003°
• Cell volume: 697.43 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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 all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0831
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No