Information card for entry 2101342

Structure parameters

• Formula: H3 O4 P
• Calculated formula: H3 O4 P
• Title of publication: Computational studies of crystalline H~3~PO~4~
• Authors of publication: Moss, G. R.; Souhassou, M.; Blessing, R. H.; Espinosa, E.; Lecomte, C.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 650 - 660
• a: 5.779 ± 0.009 Å
• b: 4.826 ± 0.004 Å
• c: 11.61 ± 0.04 Å
• α: 90°
• β: 95.26 ± 0.18°
• γ: 90°
• Cell volume: 322.4 ± 1.3 ų
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation probe: neutron
• Diffraction radiation wavelength: 1.45 Å
• Diffraction radiation type: neutron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No