Geometry & MOs

Info

ID:	5441
PubChem CID:	13164
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-102.75
Dipole, Da:	2.16
IP(EA), eV:	-10.06(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethenyl octanoate

Drug info:

PubChemData

Smile

CCCCCCCC(=O)OC=C

DOS

IR

Vibrations