Geometry & MOs

Info

ID:	8079
PubChem CID:	74897
Reduced:	NC10H11 (1)
Stoich.:	AB10C11 (1)
Weight, g/mol:	145.089149
ΔH_f, kcal/mol:	37.26
Dipole, Da:	3.68
IP(EA), eV:	-9.53(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylbutanenitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations