Geometry & MOs

Info

ID:	8857
PubChem CID:	82599
Reduced:	O2C9H16 (1)
Stoich.:	A2B9C16 (1)
Weight, g/mol:	156.11503
ΔH_f, kcal/mol:	-104.17
Dipole, Da:	2.12
IP(EA), eV:	-10.61(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl hex-2-enoate

Drug info:

PubChemData

Smile

CCCC=CC(=O)OCCC

DOS

IR

Vibrations