Geometry & MOs

Info

ID:	4928
PubChem CID:	12293
Reduced:	O2C9H18 (1)
Stoich.:	A2B9C18 (1)
Weight, g/mol:	158.13068
ΔH_f, kcal/mol:	-129.43
Dipole, Da:	1.68
IP(EA), eV:	-10.79(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl hexanoate

Drug info:

PubChemData

Smile

CCCCCC(=O)OCCC

DOS

IR

Vibrations