Information card for entry 7205296

Structure parameters

• Formula: C14 H30 N4 Nd2 O25
• Calculated formula: C14 H30 N4 Nd2 O25
• Title of publication: Tuning the porosity of lanthanide MOFs with 2,5-pyrazinedicarboxylate and the first in situ hydrothermal carboxyl transfer
• Authors of publication: Cai, Bin; Yang, Ping; Dai, Jing-Wei; Wu, Jian-Zhong
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 3
• Pages of publication: 985
• a: 6.1645 ± 0.0012 Å
• b: 10.074 ± 0.002 Å
• c: 13.503 ± 0.003 Å
• α: 68.951 ± 0.002°
• β: 80.872 ± 0.002°
• γ: 76.667 ± 0.002°
• Cell volume: 758.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.036
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0887
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No