Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-32416
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 38
- Number of elements: 5
- Element list: ['H', 'C', 'N', 'Cl', 'O']
- Chemical System: C-Cl-H-N-O
- Density: 1.5448651480692648
- Atomic Density: 0.11077636243552737
- Unit Cell Volume: 343.03346999786413
- Molar Volume: 5.436304846627301
- Full Formula: H20 C6 N2 Cl2 O8
- Reduced Formula: H10C3NClO4
- Formula Anonymous: ABC3D4E10
- Spacegroup Number: 11
- Spacegroup Symbol: P12_1/m1
- Crystal System: monoclinic
- Pointgroup: 2/m
