Information card for entry 4301356

Structure parameters

• Formula: C6 H20 N2 O8 P2
• Calculated formula: C6 H20 N2 O8 P2
• Title of publication: Metal Tetraphosphonate "Wires" and Their Corrosion Inhibiting Passive Films
• Authors of publication: Konstantinos D. Demadis; Eleni Barouda; Raphael G. Raptis; Hong Zhao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 819 - 821
• a: 6.195 ± 0.0011 Å
• b: 7.4889 ± 0.0013 Å
• c: 15.955 ± 0.003 Å
• α: 84.472 ± 0.003°
• β: 85.319 ± 0.003°
• γ: 67.881 ± 0.003°
• Cell volume: 681.7 ± 0.2 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: 0.0711
• Residual factor for significantly intense reflections: 0.0566
• Weighted residual factors for significantly intense reflections: 0.1614
• Weighted residual factors for all reflections included in the refinement: 0.1691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No