N,n-dimethylformamide
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 | 267.03 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 276.95 | 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 | 64.40 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 97.66 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 162.26 | J mol-1 K-1 |
| Rotational | 106.78 | J mol-1 K-1 |
| Vibrational | 56.73 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 325.77 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -186.47 | kJ mol-1 |
Molecular Orbitals
- 1 -550.98 eV View
- 2 -417.56 eV View
- 3 -303.28 eV View
- 4 -301.71 eV View
- 5 -301.61 eV View
- 6 -35.98 eV View
- 7 -31.50 eV View
- 8 -25.10 eV View
- 9 -23.68 eV View
- 10 -19.93 eV View
- 11 -17.25 eV View
- 12 -16.29 eV View
- 13 -15.62 eV View
- 14 -14.41 eV View
- 15 -14.14 eV View
- 16 -13.64 eV View
- 17 -12.86 eV View
- 18 -12.36 eV View
- 19 -9.15 eV View
- 20 -7.67 eV View
- 21 8.61 eV View
- 22 15.04 eV View
- 23 16.14 eV View
- 24 16.91 eV View
- 25 18.51 eV View
- 26 18.81 eV View
- 27 19.10 eV View
- 28 19.49 eV View
- 29 19.94 eV View
- 30 20.40 eV View
- 31 22.50 eV View
- 32 26.92 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 123.86 cm-1 View
- 2 133.91 cm-1 View
- 3 158.58 cm-1 View
- 4 299.12 cm-1 View
- 5 313.47 cm-1 View
- 6 419.09 cm-1 View
- 7 566.42 cm-1 View
- 8 903.86 cm-1 View
- 9 935.31 cm-1 View
- 10 964.82 cm-1 View
- 11 976.35 cm-1 View
- 12 983.80 cm-1 View
- 13 1020.22 cm-1 View
- 14 1134.16 cm-1 View
- 15 1227.51 cm-1 View
- 16 1309.38 cm-1 View
- 17 1371.70 cm-1 View
- 18 1372.86 cm-1 View
- 19 1378.10 cm-1 View
- 20 1381.42 cm-1 View
- 21 1394.50 cm-1 View
- 22 1396.90 cm-1 View
- 23 1917.19 cm-1 View
- 24 2903.00 cm-1 View
- 25 3038.28 cm-1 View
- 26 3043.84 cm-1 View
- 27 3055.64 cm-1 View
- 28 3060.45 cm-1 View
- 29 3130.54 cm-1 View
- 30 3132.85 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -6.54 | kJ mol-1 |
| Polar Solvation Energy | -20.45 | kJ mol-1 |
| Nonpolar Solvation Energy | 13.92 | kJ mol-1 |
| Surface Area | 83.32 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 3.86 | Debye |