Information card for entry 7205383

Structure parameters

• Formula: C36 H38 Nd2 O31
• Calculated formula: C36 H38 Nd2 O31
• Title of publication: Coordination polymers of flexible tetracarboxylic acids with metal ions. I. Synthesis of CH2- and (CH2)2-spaced bis(oxy)isophthalic acid ligands, and structural characterization of their polymeric adducts with lanthanoid ions
• Authors of publication: Karmakar, Anirban; Goldberg, Israel
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 1
• Pages of publication: 339
• a: 8.5679 ± 0.0003 Å
• b: 9.9939 ± 0.0003 Å
• c: 12.5472 ± 0.0005 Å
• α: 91.596 ± 0.0015°
• β: 94.8827 ± 0.0014°
• γ: 93.4052 ± 0.0016°
• Cell volume: 1068 ± 0.07 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0635
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1215
• Weighted residual factors for all reflections included in the refinement: 0.1294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No