MolCalcThe Molecule Calculator

Carbon dioxide

Molecule
Thermodynamics
Molecular Orbitals
Vibrational Frequencies
Polarity and Solvation

Molecule Viewer

Molecular Orbitals

1 -553.95 eV View
2 -553.94 eV View
3 -306.53 eV View
4 -39.14 eV View
5 -37.37 eV View
6 -18.52 eV View
7 -17.03 eV View
8 -17.03 eV View
9 -15.93 eV View
10 -10.59 eV View
11 -10.59 eV View
12 8.58 eV View
13 8.58 eV View
14 14.83 eV View
15 36.15 eV View

Vibrational Frequencies

Vibration
Vectors
Balls

1 521.11 cm^-1 View
2 1407.70 cm^-1 View
3 2386.14 cm^-1 View

Aqueous Solvation Energy at 298.15 K

Surface
Dipole
Translucent Molecule

Property	Value	Unit
Total Solvation Energy	-7.44	kJ mol^-1
Polar Solvation Energy	-13.54	kJ mol^-1
Nonpolar Solvation Energy	6.10	kJ mol^-1

Surface Area	60.47	Å²
Charge of Molecule	0
Dipole	0.01	Debye