MolCalcThe Molecule Calculator

2-fluoroethanol

Molecule
Thermodynamics
Molecular Orbitals
Vibrational Frequencies
Polarity and Solvation

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	193.25	kJ mol^-1
Total (Trans. + Rot. + Vib.)	203.17	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	38.53	J mol^-1 K^-1
Total (Trans. + Rot. + Vib.)	71.79	J mol^-1 K^-1

Entropy
Property	Value	Unit
Translational	160.62	J mol^-1 K^-1
Rotational	101.43	J mol^-1 K^-1
Vibrational	27.91	J mol^-1 K^-1
Total (Trans. + Rot. + Vib.)	289.95	J mol^-1 K^-1

Other Properties
Property	Value	Unit
Heat of Formation	-421.91	kJ mol^-1

Molecular Orbitals

1 -705.45 eV View
2 -551.27 eV View
3 -302.61 eV View
4 -302.16 eV View
5 -40.81 eV View
6 -35.49 eV View
7 -26.06 eV View
8 -21.86 eV View
9 -17.79 eV View
10 -17.04 eV View
11 -15.61 eV View
12 -15.46 eV View
13 -13.70 eV View
14 -12.45 eV View
15 -11.39 eV View
16 -10.89 eV View
17 -9.50 eV View
18 14.80 eV View
19 15.82 eV View
20 17.71 eV View
21 18.36 eV View
22 19.30 eV View
23 19.38 eV View
24 19.84 eV View
25 21.53 eV View

Vibrational Frequencies

Vibration
Vectors
Balls

1 120.91 cm^-1 View
2 340.38 cm^-1 View
3 356.08 cm^-1 View
4 553.36 cm^-1 View
5 881.52 cm^-1 View
6 939.03 cm^-1 View
7 1028.42 cm^-1 View
8 1041.71 cm^-1 View
9 1091.69 cm^-1 View
10 1128.35 cm^-1 View
11 1155.81 cm^-1 View
12 1327.65 cm^-1 View
13 1353.74 cm^-1 View
14 1378.73 cm^-1 View
15 1394.99 cm^-1 View
16 1512.73 cm^-1 View
17 2949.83 cm^-1 View
18 2980.88 cm^-1 View
19 3024.56 cm^-1 View
20 3035.20 cm^-1 View
21 3885.46 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