Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-52835
- Created at: Sept. 4, 2022, 2:36 p.m.
- Last updated at: Sept. 4, 2022, 2:36 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 22
- Number of elements: 4
- Element list: ['H', 'C', 'N', 'Cl']
- Chemical System: C-Cl-H-N
- Density: 1.5894601248783127
- Atomic Density: 0.08663900249377154
- Unit Cell Volume: 253.9272079174916
- Molar Volume: 6.950842676695094
- Full Formula: H8 C2 N10 Cl2
- Reduced Formula: H4CN5Cl
- Formula Anonymous: ABC4D5
- Spacegroup Number: 9
- Spacegroup Symbol: C1c1
- Crystal System: monoclinic
- Pointgroup: m
