Information card for entry 4311331

Structure parameters

• Formula: C6 H14 N O6 P Zn2
• Calculated formula: C6 H14 N O6 P Zn2
• Title of publication: Triethanolamine Zinc Phosphite, (C6H13NO3)Zn2(HPO3): A Templated Network or a Network of Clusters?
• Authors of publication: Jillian A. Johnstone; William T. A. Harrison
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4567 - 4569
• a: 8.4216 ± 0.0004 Å
• b: 9.9262 ± 0.0005 Å
• c: 12.8494 ± 0.0006 Å
• α: 90°
• β: 91.824 ± 0.001°
• γ: 90°
• Cell volume: 1073.59 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0452
• Weighted residual factors for all reflections included in the refinement: 0.0475
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No