Information card for entry 4340481

Structure parameters

• Common name: phosphorus nitride imide
• Chemical name: Tetraphosphorus hexanitride imide
• Formula: H N7 P4
• Calculated formula: H N7 P4
• Title of publication: High-Pressure Polymorph of Phosphorus Nitride Imide HP4N7 Representing a New Framework Topology.
• Authors of publication: Baumann, Dominik; Schnick, Wolfgang
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 15
• Pages of publication: 7977
• a: 12.8732 ± 0.0014 Å
• b: 4.6587 ± 0.0004 Å
• c: 8.3222 ± 0.0008 Å
• α: 90°
• β: 102.351 ± 0.003°
• γ: 90°
• Cell volume: 487.55 ± 0.08 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0769
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No