Geometry & MOs

Info

ID:	16888
PubChem CID:	478553
Reduced:	NC17H19 (1)
Stoich.:	AB17C19 (1)
Weight, g/mol:	237.15175
ΔH_f, kcal/mol:	51.35
Dipole, Da:	1.82
IP(EA), eV:	-8.18(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(1-phenylbut-3-enyl)aniline

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(CC=C)C2=CC=CC=C2

DOS

IR

Vibrations