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-1238663
- Created at: Sept. 4, 2022, 2:47 p.m.
- Last updated at: Nov. 28, 2021, 1:38 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 84
- Number of elements: 6
- Element list: ['Mn', 'H', 'C', 'N', 'Cl', 'O']
- Chemical System: C-Cl-H-Mn-N-O
- Density: 1.0869161126080478
- Atomic Density: 0.05646916276259333
- Unit Cell Volume: 1487.5375495321462
- Molar Volume: 10.66447679650959
- Full Formula: Mn4 H48 C8 N4 Cl12 O8
- Reduced Formula: MnH12C2NCl3O2
- Formula Anonymous: ABC2D2E3F12
- Spacegroup Number: 64
- Spacegroup Symbol: Cmce
- Crystal System: orthorhombic
- Pointgroup: mmm
