Information card for entry 7002890

Structure parameters

• Formula: C76 H62 N24 O15 Pr2
• Calculated formula: C76 H62 N24 O15 Pr2
• Title of publication: Systematic investigation of an array of TCNQ lanthanide complexes: synthesis, structure and magnetic properties
• Authors of publication: Zhang, Juwen; Yan, Pengfei; Li, Guangming; Hou, Guangfeng; Suda, Masayuki; Einaga, Yasuaki
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 47
• Pages of publication: 10466 - 10473
• a: 11.849 ± 0.002 Å
• b: 13.655 ± 0.002 Å
• c: 13.996 ± 0.002 Å
• α: 105.744 ± 0.002°
• β: 102.464 ± 0.002°
• γ: 100.294 ± 0.002°
• Cell volume: 2059.3 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1626
• Weighted residual factors for all reflections included in the refinement: 0.1672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No