Geometry & MOs

Info

ID:	21496
PubChem CID:	588653
Reduced:	NH9C10 (1)
Stoich.:	AB9C10 (1)
Weight, g/mol:	143.073499
ΔH_f, kcal/mol:	62.03
Dipole, Da:	3.68
IP(EA), eV:	-9.43(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylbut-3-enenitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CCC#N

DOS

IR

Vibrations