Geometry & MOs

Info

ID:	270892
PubChem CID:	103638586
Reduced:	NSC16H19 (1)
Stoich.:	ABC16D19 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	51.59
Dipole, Da:	1.46
IP(EA), eV:	-9.05(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-N-[(E)-3-phenylprop-2-enyl]pentan-1-amine

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC/C=C/C2=CC=CC=C2

DOS

IR

Vibrations