Geometry & MOs

Info

ID:	9911
PubChem CID:	94615
Reduced:	O2C23H46 (1)
Stoich.:	A2B23C46 (1)
Weight, g/mol:	354.349781
ΔH_f, kcal/mol:	-194.52
Dipole, Da:	1.72
IP(EA), eV:	-10.51(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

icosyl propanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCCOC(=O)CC

DOS

IR

Vibrations