Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-689545
- Created at: Sept. 4, 2022, 3:52 p.m.
- Last updated at: Sept. 4, 2022, 3:52 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 84
- Number of elements: 5
- Element list: ['C', 'H', 'I', 'N', 'O']
- Chemical System: C-H-I-N-O
- Density: 2.241874488365935
- Atomic Density: 0.11384118108297171
- Unit Cell Volume: 737.8700677637704
- Molar Volume: 5.289949298409718
- Full Formula: H48 C16 I4 N4 O12
- Reduced Formula: H12C4INO3
- Formula Anonymous: ABC3D4E12
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm
