N-(1,3-thiazol-2-yl)methanesulfonamide
Molecule Viewer
Thermodynamics at 298.15 K and standard pressure
| Enthalpy | ||
| Property | Value | Unit |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 3.72 | kJ mol-1 |
| Vibrational | 296.39 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 306.31 | kJ mol-1 |
| Heat Capacity at Constant Pressure | ||
| Property | Value | Unit |
| Translational | 20.79 | J mol-1 K-1 |
| Rotational | 12.47 | J mol-1 K-1 |
| Vibrational | 136.51 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 169.76 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 173.37 | J mol-1 K-1 |
| Rotational | 127.58 | J mol-1 K-1 |
| Vibrational | 129.75 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 430.69 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -129.21 | kJ mol-1 |
Molecular Orbitals
- 1 -2485.70 eV View
- 2 -2475.33 eV View
- 3 -547.97 eV View
- 4 -547.71 eV View
- 5 -417.67 eV View
- 6 -416.79 eV View
- 7 -303.49 eV View
- 8 -302.10 eV View
- 9 -301.29 eV View
- 10 -300.86 eV View
- 11 -249.80 eV View
- 12 -240.54 eV View
- 13 -185.55 eV View
- 14 -185.48 eV View
- 15 -185.44 eV View
- 16 -176.21 eV View
- 17 -176.16 eV View
- 18 -176.07 eV View
- 19 -38.36 eV View
- 20 -34.44 eV View
- 21 -33.54 eV View
- 22 -31.14 eV View
- 23 -27.80 eV View
- 24 -27.37 eV View
- 25 -25.33 eV View
- 26 -22.12 eV View
- 27 -20.28 eV View
- 28 -19.58 eV View
- 29 -18.15 eV View
- 30 -17.44 eV View
- 31 -16.56 eV View
- 32 -16.24 eV View
- 33 -15.39 eV View
- 34 -15.02 eV View
- 35 -14.51 eV View
- 36 -13.74 eV View
- 37 -13.35 eV View
- 38 -12.29 eV View
- 39 -11.26 eV View
- 40 -9.86 eV View
- 41 -9.09 eV View
- 42 -9.02 eV View
- 43 -8.92 eV View
- 44 -8.80 eV View
- 45 -8.50 eV View
- 46 -6.84 eV View
- 47 6.13 eV View
- 48 7.29 eV View
- 49 9.50 eV View
- 50 9.64 eV View
- 51 10.07 eV View
- 52 12.64 eV View
- 53 14.23 eV View
- 54 14.39 eV View
- 55 16.61 eV View
- 56 17.32 eV View
- 57 17.43 eV View
- 58 18.17 eV View
- 59 19.06 eV View
- 60 19.12 eV View
- 61 21.26 eV View
- 62 22.12 eV View
- 63 24.23 eV View
- 64 27.06 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -32.38 | kJ mol-1 |
| Polar Solvation Energy | -55.22 | kJ mol-1 |
| Nonpolar Solvation Energy | 22.86 | kJ mol-1 |
| Surface Area | 145.82 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 4.55 | Debye |