Geometry & MOs

Info

ID:	53087
PubChem CID:	14709542
Reduced:	O2C9H12 (1)
Stoich.:	A2B9C12 (1)
Weight, g/mol:	220.109944
ΔH_f, kcal/mol:	-48.62
Dipole, Da:	1.01
IP(EA), eV:	-8.8(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-(phenoxymethyl)but-2-enoate

Drug info:

PubChemData

Smile

CC(=C(C1=CC=CO1)OC)C

DOS

IR

Vibrations