Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-96874
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 42
- Number of elements: 5
- Element list: ['Cu', 'H', 'N', 'Cl', 'O']
- Chemical System: Cl-Cu-H-N-O
- Density: 2.096099832787508
- Atomic Density: 0.0955373522979661
- Unit Cell Volume: 439.6186307216109
- Molar Volume: 6.303441130771431
- Full Formula: Cu2 H24 N4 Cl8 O4
- Reduced Formula: CuH12N2(Cl2O)2
- Formula Anonymous: AB2C2D4E12
- Spacegroup Number: 136
- Spacegroup Symbol: P4_2/mnm
- Crystal System: tetragonal
- Pointgroup: 4/mmm
