Naphthalene
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 | 395.73 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 405.64 | 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 | 96.66 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 129.91 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 169.26 | J mol-1 K-1 |
| Rotational | 121.00 | J mol-1 K-1 |
| Vibrational | 56.68 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 346.94 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 170.04 | kJ mol-1 |
Molecular Orbitals
- 1 -300.36 eV View
- 2 -300.36 eV View
- 3 -300.11 eV View
- 4 -300.11 eV View
- 5 -300.10 eV View
- 6 -300.10 eV View
- 7 -300.08 eV View
- 8 -300.08 eV View
- 9 -300.08 eV View
- 10 -300.08 eV View
- 11 -30.40 eV View
- 12 -28.57 eV View
- 13 -26.89 eV View
- 14 -25.76 eV View
- 15 -25.04 eV View
- 16 -21.54 eV View
- 17 -21.06 eV View
- 18 -20.58 eV View
- 19 -17.61 eV View
- 20 -17.56 eV View
- 21 -16.88 eV View
- 22 -15.46 eV View
- 23 -14.99 eV View
- 24 -14.34 eV View
- 25 -14.05 eV View
- 26 -13.75 eV View
- 27 -13.32 eV View
- 28 -12.58 eV View
- 29 -11.31 eV View
- 30 -11.23 eV View
- 31 -10.83 eV View
- 32 -9.00 eV View
- 33 -7.15 eV View
- 34 -6.20 eV View
- 35 5.65 eV View
- 36 6.82 eV View
- 37 8.94 eV View
- 38 11.40 eV View
- 39 15.16 eV View
- 40 15.53 eV View
- 41 16.33 eV View
- 42 16.45 eV View
- 43 17.89 eV View
- 44 18.74 eV View
- 45 19.31 eV View
- 46 19.68 eV View
- 47 19.86 eV View
- 48 20.00 eV View
- 49 21.85 eV View
- 50 23.11 eV View
- 51 23.34 eV View
- 52 24.00 eV View
- 53 25.73 eV View
- 54 26.05 eV View
- 55 27.92 eV View
- 56 28.26 eV View
- 57 31.71 eV View
- 58 31.95 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 158.34 cm-1 View
- 2 159.14 cm-1 View
- 3 335.19 cm-1 View
- 4 390.67 cm-1 View
- 5 428.63 cm-1 View
- 6 462.16 cm-1 View
- 7 520.87 cm-1 View
- 8 524.05 cm-1 View
- 9 544.25 cm-1 View
- 10 635.61 cm-1 View
- 11 743.15 cm-1 View
- 12 748.95 cm-1 View
- 13 800.23 cm-1 View
- 14 808.52 cm-1 View
- 15 850.87 cm-1 View
- 16 911.21 cm-1 View
- 17 912.40 cm-1 View
- 18 919.05 cm-1 View
- 19 953.52 cm-1 View
- 20 980.27 cm-1 View
- 21 1001.49 cm-1 View
- 22 1018.10 cm-1 View
- 23 1087.41 cm-1 View
- 24 1114.98 cm-1 View
- 25 1123.93 cm-1 View
- 26 1127.81 cm-1 View
- 27 1156.02 cm-1 View
- 28 1157.21 cm-1 View
- 29 1185.93 cm-1 View
- 30 1231.99 cm-1 View
- 31 1255.12 cm-1 View
- 32 1411.63 cm-1 View
- 33 1435.52 cm-1 View
- 34 1486.31 cm-1 View
- 35 1581.37 cm-1 View
- 36 1593.56 cm-1 View
- 37 1677.95 cm-1 View
- 38 1778.63 cm-1 View
- 39 1796.83 cm-1 View
- 40 1828.36 cm-1 View
- 41 3050.65 cm-1 View
- 42 3051.62 cm-1 View
- 43 3052.72 cm-1 View
- 44 3054.17 cm-1 View
- 45 3064.54 cm-1 View
- 46 3065.35 cm-1 View
- 47 3076.46 cm-1 View
- 48 3076.52 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 2.21 | kJ mol-1 |
| Polar Solvation Energy | -8.47 | kJ mol-1 |
| Nonpolar Solvation Energy | 10.66 | kJ mol-1 |
| Surface Area | 121.32 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.00 | Debye |