Table mix-ins: ['Structure', 'Thermodynamics']
Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']
Base Information:
- Database Entry ID: mp-696290
- Created at: Sept. 4, 2022, 2:44 p.m.
- Last updated at: Nov. 28, 2021, 1:36 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 25
- Number of elements: 6
- Element list: ['Cu', 'H', 'C', 'N', 'Cl', 'O']
- Chemical System: C-Cl-Cu-H-N-O
- Density: 1.8063137373115896
- Atomic Density: 0.08127261722645361
- Unit Cell Volume: 307.60668049290643
- Molar Volume: 7.409802914578515
- Full Formula: Cu1 H8 C4 N8 Cl2 O2
- Reduced Formula: CuH8C4N8(ClO)2
- Formula Anonymous: AB2C2D4E8F8
- Spacegroup Number: 2
- Spacegroup Symbol: P-1
- Crystal System: triclinic
- Pointgroup: -1
