Information card for entry 8106786

Structure parameters

• Chemical name: 2,2'-diamino[1,1'-biphenyl]-4,4'-dicarboxylic acid dihydrate
• Formula: C14 H16 N2 O6
• Calculated formula: C14 H16 N2 O6
• Title of publication: Crystal structure of 2,2′-diamino-[1,1′-biphenyl]-4,4′-dicarboxylic acid dihydrate, C14H16N2O6
• Authors of publication: Dikhtiarenko, Alla; Olivos Suarez, Alma I.; Pustovarenko, Alexey; García-Granda, Santiago; Gascon, Jorge
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 1
• Pages of publication: 65 - 67
• a: 10.0254 ± 0.0005 Å
• b: 11.2726 ± 0.0006 Å
• c: 13.4494 ± 0.0007 Å
• α: 111.535 ± 0.002°
• β: 92.068 ± 0.002°
• γ: 102.644 ± 0.002°
• Cell volume: 1368.16 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0728
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1181
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No