Geometry & MOs

Info

ID:	327712
PubChem CID:	126690838
Reduced:	O3H5C6 (2)
Stoich.:	A3B5C6 (2)
Weight, g/mol:	206.094294
ΔH_f, kcal/mol:	-78.84
Dipole, Da:	4.55
IP(EA), eV:	-9.61(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethoxy-2-methylphenyl) prop-2-enoate

Drug info:

PubChemData

Smile

CCC(=O)OCCOC1=C2C=C3C(=C1OC3=O)O2

DOS

IR

Vibrations