Structure
Basic information
Pretty formula | H4CSN2 |
Full formula | H48C12S12N24 |
Tags | Thiourea - VI |
Constituent elements | C; H; N; S; |
Number of elements | 4 |
Number of sites | 96 |
Volume | 1,068.16842 Å3 |
Density | 1.42002 g/cm3 |
Source | Materials Project |
Space group
Spacegroup Number | 62 |
Hermann Mauguin | Pnma |
Hall | -P 2ac 2n |
Crystal System | Orthorhombic |
Calculated Energies
Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
---|---|---|---|---|---|
-544.52145 eV | -5.67210 eV | -0.39494 eV | 3.37420 eV | 0.00198 eV | 0.04050 eV |