Information card for entry 7215179

Structure parameters

• Formula: C78 H84 N14 Ni3 O18
• Calculated formula: C78 H74 N14 Ni3 O18
• Title of publication: Syntheses, structures, and photoluminescent properties of a series of coordination polymers based on a new 2′-carboxybiphenyl-4-ylmethylaminodiacetic acid and different N-donor ligands
• Authors of publication: Han, Rong-Min; Ma, Jian-Fang; Liu, Ying-Ying; Yang, Jin
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 28
• Pages of publication: 5641
• a: 9.653 ± 0.0004 Å
• b: 13.823 ± 0.0005 Å
• c: 15.233 ± 0.0008 Å
• α: 81.369 ± 0.004°
• β: 78.69 ± 0.004°
• γ: 75.595 ± 0.004°
• Cell volume: 1919.45 ± 0.15 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: 0.0877
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No