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 | 419.63 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 429.54 | 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 | 100.92 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 134.17 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 167.26 | J mol-1 K-1 |
| Rotational | 116.54 | J mol-1 K-1 |
| Vibrational | 71.68 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 355.48 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -49.36 | kJ mol-1 |
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 127.13 cm-1 View
- 2 182.56 cm-1 View
- 3 237.19 cm-1 View
- 4 273.82 cm-1 View
- 5 275.65 cm-1 View
- 6 361.35 cm-1 View
- 7 369.62 cm-1 View
- 8 428.22 cm-1 View
- 9 466.24 cm-1 View
- 10 486.87 cm-1 View
- 11 506.82 cm-1 View
- 12 632.65 cm-1 View
- 13 880.03 cm-1 View
- 14 931.22 cm-1 View
- 15 932.86 cm-1 View
- 16 965.04 cm-1 View
- 17 978.82 cm-1 View
- 18 978.89 cm-1 View
- 19 989.49 cm-1 View
- 20 1035.33 cm-1 View
- 21 1045.69 cm-1 View
- 22 1210.90 cm-1 View
- 23 1230.31 cm-1 View
- 24 1240.51 cm-1 View
- 25 1256.00 cm-1 View
- 26 1278.43 cm-1 View
- 27 1334.80 cm-1 View
- 28 1338.88 cm-1 View
- 29 1357.08 cm-1 View
- 30 1362.18 cm-1 View
- 31 1370.12 cm-1 View
- 32 1374.36 cm-1 View
- 33 1380.24 cm-1 View
- 34 1382.34 cm-1 View
- 35 1395.41 cm-1 View
- 36 1398.66 cm-1 View
- 37 2022.50 cm-1 View
- 38 2234.90 cm-1 View
- 39 2954.88 cm-1 View
- 40 3047.36 cm-1 View
- 41 3051.79 cm-1 View
- 42 3054.54 cm-1 View
- 43 3062.61 cm-1 View
- 44 3064.22 cm-1 View
- 45 3105.58 cm-1 View
- 46 3105.84 cm-1 View
- 47 3111.48 cm-1 View
- 48 3134.56 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 0.00 | kJ mol-1 |
| Polar Solvation Energy | 0.00 | kJ mol-1 |
| Nonpolar Solvation Energy | 0.00 | kJ mol-1 |
| Surface Area | Å2 | |
| Charge of Molecule | 0 | |
| Dipole | 0.00 | Debye |