Information card for entry 4302115

Structure parameters

• Common name: Nd(H5L) a
• Formula: C8 H19 Nd O16 P4
• Calculated formula: C8 H16 Nd O16 P4
• Title of publication: 1,4-Phenylenebis(methylidyne)tetrakis(phosphonic acid): A New Building Block in Metal Organic Framework Synthesis
• Authors of publication: Monika Plabst; Thomas Bein
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 4331 - 4341
• a: 5.673 Å
• b: 12.193 Å
• c: 14.474 Å
• α: 73.03°
• β: 85.47°
• γ: 76.74°
• Cell volume: 931.978 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0378
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0519
• Weighted residual factors for all reflections included in the refinement: 0.0545
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No