Geometry & MOs

Info

ID:	20397
PubChem CID:	583720
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	190.09938
ΔH_f, kcal/mol:	-59.6
Dipole, Da:	2.95
IP(EA), eV:	-9.82(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 4-ethylbenzoate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)OCC=C

DOS

IR

Vibrations