Methoxymethylsulfanylethane
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 | 366.74 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 376.65 | 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 | 95.77 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 129.03 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.91 | J mol-1 K-1 |
| Rotational | 116.33 | J mol-1 K-1 |
| Vibrational | 103.05 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 386.28 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -197.01 | kJ mol-1 |
Molecular Orbitals
- 1 -2472.65 eV View
- 2 -551.90 eV View
- 3 -302.69 eV View
- 4 -301.95 eV View
- 5 -301.45 eV View
- 6 -300.58 eV View
- 7 -238.07 eV View
- 8 -173.76 eV View
- 9 -173.68 eV View
- 10 -173.61 eV View
- 11 -36.02 eV View
- 12 -28.01 eV View
- 13 -25.94 eV View
- 14 -24.08 eV View
- 15 -22.34 eV View
- 16 -20.11 eV View
- 17 -17.00 eV View
- 18 -16.56 eV View
- 19 -16.23 eV View
- 20 -15.83 eV View
- 21 -14.86 eV View
- 22 -13.84 eV View
- 23 -13.46 eV View
- 24 -13.02 eV View
- 25 -12.34 eV View
- 26 -11.29 eV View
- 27 -10.05 eV View
- 28 -8.75 eV View
- 29 -7.94 eV View
- 30 10.95 eV View
- 31 11.39 eV View
- 32 15.18 eV View
- 33 16.69 eV View
- 34 17.16 eV View
- 35 17.94 eV View
- 36 18.18 eV View
- 37 18.72 eV View
- 38 18.98 eV View
- 39 19.08 eV View
- 40 19.35 eV View
- 41 20.09 eV View
- 42 20.70 eV View
- 43 20.73 eV View
- 44 21.95 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 44.92 cm-1 View
- 2 60.15 cm-1 View
- 3 111.51 cm-1 View
- 4 164.66 cm-1 View
- 5 170.18 cm-1 View
- 6 219.15 cm-1 View
- 7 307.31 cm-1 View
- 8 374.13 cm-1 View
- 9 491.19 cm-1 View
- 10 660.12 cm-1 View
- 11 713.95 cm-1 View
- 12 788.95 cm-1 View
- 13 882.70 cm-1 View
- 14 1002.80 cm-1 View
- 15 1008.80 cm-1 View
- 16 1014.13 cm-1 View
- 17 1018.92 cm-1 View
- 18 1048.92 cm-1 View
- 19 1120.37 cm-1 View
- 20 1128.18 cm-1 View
- 21 1144.37 cm-1 View
- 22 1197.95 cm-1 View
- 23 1223.08 cm-1 View
- 24 1235.88 cm-1 View
- 25 1332.32 cm-1 View
- 26 1349.02 cm-1 View
- 27 1358.99 cm-1 View
- 28 1359.59 cm-1 View
- 29 1381.22 cm-1 View
- 30 1394.63 cm-1 View
- 31 1401.85 cm-1 View
- 32 1409.76 cm-1 View
- 33 2960.03 cm-1 View
- 34 2981.45 cm-1 View
- 35 3040.84 cm-1 View
- 36 3043.09 cm-1 View
- 37 3052.75 cm-1 View
- 38 3072.35 cm-1 View
- 39 3076.85 cm-1 View
- 40 3083.86 cm-1 View
- 41 3142.74 cm-1 View
- 42 3178.29 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 0.02 | kJ mol-1 |
| Polar Solvation Energy | -21.02 | kJ mol-1 |
| Nonpolar Solvation Energy | 21.03 | kJ mol-1 |
| Surface Area | 114.09 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.40 | Debye |