Geometry & MOs

Info

ID:	12480
PubChem CID:	138498
Reduced:	NOH13C16 (1)
Stoich.:	ABC13D16 (1)
Weight, g/mol:	235.099714
ΔH_f, kcal/mol:	52.96
Dipole, Da:	3.84
IP(EA), eV:	-8.96(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-2-phenylprop-2-enenitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=C(C#N)C2=CC=CC=C2

DOS

IR

Vibrations