Information card for entry 1011023

Structure parameters

• Chemical name: Dihydrogen oxide
• Mineral name: Ice Ih
• Formula: H2 O
• Calculated formula: H2 O
• SMILES: O
• Title of publication: A Theory of Water and Ionic Solution, with Particular Reference to Hydrogen and Hydroxyl Ions
• Authors of publication: Bernal, J D; Fowler, R H
• Journal of publication: Journal of Chemical Physics
• Year of publication: 1933
• Journal volume: 1
• Pages of publication: 515 - 548
• a: 7.82 Å
• b: 7.82 Å
• c: 7.36 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 389.8 ų
• Number of distinct elements: 2
• Space group number: 185
• Hermann-Mauguin space group symbol: P 63 c m
• Hall space group symbol: P 6c -2
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No