Information card for entry 7712196

Structure parameters

• Formula: C29 H31 Gd N4 O12 P2
• Calculated formula: C29 H31 Gd N4 O12 P2
• Title of publication: Magnetic and optical studies of a new family of multidimensional and multiproperty PO-lanthanide(III) derived systems.
• Authors of publication: Pilichos, Evangelos; Tubau, Ànnia; Speed, Saskia; Font-Bardia, Mercè; Escuer, Albert; Grabulosa, Arnald; Mayans, Júlia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 8
• Pages of publication: 2485 - 2494
• a: 17.0768 ± 0.0007 Å
• b: 9.9525 ± 0.0005 Å
• c: 20.5086 ± 0.001 Å
• α: 90°
• β: 104.076 ± 0.002°
• γ: 90°
• Cell volume: 3380.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0428
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.0571
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No