Geometry & MOs

Info

ID:	171314
PubChem CID:	75357718
Reduced:	ClNOC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	225.128427
ΔH_f, kcal/mol:	-43.86
Dipole, Da:	2.83
IP(EA), eV:	-8.77(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-methyl-3-phenyl-N-propylprop-2-en-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CCCNC/C=C/C1=CC=CC=C1OC.Cl

DOS

IR

Vibrations