Butan-1-amine
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 | 397.47 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 407.38 | 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 | 73.58 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 106.84 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 162.27 | J mol-1 K-1 |
| Rotational | 108.85 | J mol-1 K-1 |
| Vibrational | 58.75 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 329.88 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -87.53 | kJ mol-1 |
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 92.25 cm-1 View
- 2 163.56 cm-1 View
- 3 202.46 cm-1 View
- 4 243.64 cm-1 View
- 5 355.45 cm-1 View
- 6 444.27 cm-1 View
- 7 496.64 cm-1 View
- 8 813.20 cm-1 View
- 9 868.42 cm-1 View
- 10 897.90 cm-1 View
- 11 945.89 cm-1 View
- 12 990.13 cm-1 View
- 13 1025.75 cm-1 View
- 14 1062.25 cm-1 View
- 15 1085.36 cm-1 View
- 16 1118.64 cm-1 View
- 17 1137.99 cm-1 View
- 18 1148.39 cm-1 View
- 19 1151.91 cm-1 View
- 20 1177.73 cm-1 View
- 21 1206.02 cm-1 View
- 22 1285.69 cm-1 View
- 23 1331.01 cm-1 View
- 24 1360.39 cm-1 View
- 25 1384.84 cm-1 View
- 26 1400.73 cm-1 View
- 27 1410.58 cm-1 View
- 28 1416.62 cm-1 View
- 29 1419.27 cm-1 View
- 30 1435.20 cm-1 View
- 31 1670.77 cm-1 View
- 32 2884.31 cm-1 View
- 33 2947.65 cm-1 View
- 34 2956.21 cm-1 View
- 35 2960.72 cm-1 View
- 36 3030.86 cm-1 View
- 37 3038.65 cm-1 View
- 38 3043.25 cm-1 View
- 39 3087.00 cm-1 View
- 40 3168.90 cm-1 View
- 41 3386.94 cm-1 View
- 42 3522.20 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 12.55 | kJ mol-1 |
| Polar Solvation Energy | -7.63 | kJ mol-1 |
| Nonpolar Solvation Energy | 20.19 | kJ mol-1 |
| Surface Area | 88.77 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.50 | Debye |