Geometry & MOs

Info

ID:	296427
PubChem CID:	117573737
Reduced:	ON2C10H14 (1)
Stoich.:	AB2C10D14 (1)
Weight, g/mol:	202.146999
ΔH_f, kcal/mol:	8.63
Dipole, Da:	3.55
IP(EA), eV:	-9.34(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-phenylethylamino)methyl]butanenitrile

Drug info:

PubChemData

Smile

CCC(CNCC1=CC=CO1)C#N

DOS

IR

Vibrations