MolCalcThe Molecule Calculator

Methoxymethane

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	207.78	kJ mol^-1
Total (Trans. + Rot. + Vib.)	217.69	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	31.77	J mol^-1 K^-1
Total (Trans. + Rot. + Vib.)	65.03	J mol^-1 K^-1

Entropy
Property	Value	Unit
Translational	156.51	J mol^-1 K^-1
Rotational	92.19	J mol^-1 K^-1
Vibrational	24.07	J mol^-1 K^-1
Total (Trans. + Rot. + Vib.)	272.77	J mol^-1 K^-1

Other Properties
Property	Value	Unit
Heat of Formation	-201.92	kJ mol^-1

Molecular Orbitals

1 -551.36 eV View
2 -301.75 eV View
3 -301.74 eV View
4 -35.55 eV View
5 -25.20 eV View
6 -22.53 eV View
7 -16.67 eV View
8 -16.32 eV View
9 -15.85 eV View
10 -14.26 eV View
11 -12.97 eV View
12 -10.53 eV View
13 -9.06 eV View
14 15.60 eV View
15 17.75 eV View
16 18.41 eV View
17 18.86 eV View
18 19.27 eV View
19 19.32 eV View
20 19.73 eV View
21 22.20 eV View

Vibrational Frequencies

Vibration
Vectors
Balls

1 168.27 cm^-1 View
2 214.30 cm^-1 View
3 474.20 cm^-1 View
4 995.33 cm^-1 View
5 1006.77 cm^-1 View
6 1015.12 cm^-1 View
7 1030.98 cm^-1 View
8 1183.60 cm^-1 View
9 1190.00 cm^-1 View
10 1355.12 cm^-1 View
11 1361.17 cm^-1 View
12 1365.05 cm^-1 View
13 1366.05 cm^-1 View
14 1381.86 cm^-1 View
15 1400.04 cm^-1 View
16 3036.81 cm^-1 View
17 3041.01 cm^-1 View
18 3074.99 cm^-1 View
19 3075.66 cm^-1 View
20 3144.63 cm^-1 View
21 3145.00 cm^-1 View

Aqueous Solvation Energy at 298.15 K

Surface
Dipole
Translucent Molecule

Property	Value	Unit
Total Solvation Energy	1.61	kJ mol^-1
Polar Solvation Energy	-7.35	kJ mol^-1
Nonpolar Solvation Energy	8.99	kJ mol^-1

Surface Area	72.02	Å²
Charge of Molecule	0
Dipole	1.46	Debye