Ethoxybenzene
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 | 432.61 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 442.53 | 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 | 106.37 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 139.63 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 168.67 | J mol-1 K-1 |
| Rotational | 120.75 | J mol-1 K-1 |
| Vibrational | 90.15 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 379.56 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -85.36 | kJ mol-1 |
Molecular Orbitals
- 1 -551.98 eV View
- 2 -302.17 eV View
- 3 -301.70 eV View
- 4 -300.60 eV View
- 5 -300.22 eV View
- 6 -300.16 eV View
- 7 -299.89 eV View
- 8 -299.86 eV View
- 9 -299.82 eV View
- 10 -36.07 eV View
- 11 -29.56 eV View
- 12 -26.88 eV View
- 13 -26.03 eV View
- 14 -25.36 eV View
- 15 -22.30 eV View
- 16 -20.98 eV View
- 17 -20.07 eV View
- 18 -18.08 eV View
- 19 -16.49 eV View
- 20 -16.30 eV View
- 21 -15.61 eV View
- 22 -15.51 eV View
- 23 -14.57 eV View
- 24 -14.38 eV View
- 25 -13.83 eV View
- 26 -12.89 eV View
- 27 -12.83 eV View
- 28 -12.30 eV View
- 29 -11.86 eV View
- 30 -10.66 eV View
- 31 -10.27 eV View
- 32 -7.74 eV View
- 33 -6.54 eV View
- 34 7.31 eV View
- 35 7.55 eV View
- 36 13.77 eV View
- 37 14.37 eV View
- 38 15.50 eV View
- 39 16.17 eV View
- 40 17.01 eV View
- 41 17.79 eV View
- 42 18.66 eV View
- 43 18.85 eV View
- 44 19.18 eV View
- 45 19.77 eV View
- 46 20.09 eV View
- 47 20.31 eV View
- 48 21.03 eV View
- 49 21.38 eV View
- 50 23.72 eV View
- 51 24.23 eV View
- 52 24.54 eV View
- 53 25.20 eV View
- 54 29.77 eV View
- 55 31.30 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 48.34 cm-1 View
- 2 70.34 cm-1 View
- 3 163.96 cm-1 View
- 4 200.15 cm-1 View
- 5 323.32 cm-1 View
- 6 362.23 cm-1 View
- 7 401.06 cm-1 View
- 8 468.49 cm-1 View
- 9 506.17 cm-1 View
- 10 591.95 cm-1 View
- 11 629.08 cm-1 View
- 12 643.66 cm-1 View
- 13 775.61 cm-1 View
- 14 822.52 cm-1 View
- 15 845.86 cm-1 View
- 16 874.24 cm-1 View
- 17 926.59 cm-1 View
- 18 967.32 cm-1 View
- 19 973.81 cm-1 View
- 20 1009.46 cm-1 View
- 21 1039.73 cm-1 View
- 22 1089.57 cm-1 View
- 23 1107.33 cm-1 View
- 24 1111.34 cm-1 View
- 25 1120.85 cm-1 View
- 26 1141.57 cm-1 View
- 27 1154.52 cm-1 View
- 28 1162.43 cm-1 View
- 29 1188.43 cm-1 View
- 30 1252.64 cm-1 View
- 31 1312.82 cm-1 View
- 32 1318.54 cm-1 View
- 33 1381.29 cm-1 View
- 34 1395.82 cm-1 View
- 35 1399.03 cm-1 View
- 36 1407.20 cm-1 View
- 37 1411.51 cm-1 View
- 38 1555.78 cm-1 View
- 39 1591.36 cm-1 View
- 40 1780.06 cm-1 View
- 41 1790.53 cm-1 View
- 42 2906.43 cm-1 View
- 43 3025.21 cm-1 View
- 44 3028.61 cm-1 View
- 45 3055.71 cm-1 View
- 46 3061.88 cm-1 View
- 47 3070.26 cm-1 View
- 48 3080.57 cm-1 View
- 49 3085.16 cm-1 View
- 50 3091.59 cm-1 View
- 51 3184.80 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 10.91 | kJ mol-1 |
| Polar Solvation Energy | -9.89 | kJ mol-1 |
| Nonpolar Solvation Energy | 20.82 | kJ mol-1 |
| Surface Area | 117.49 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.55 | Debye |