Geometry & MOs

Info

ID:	270890
PubChem CID:	103638581
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	258.11907
ΔH_f, kcal/mol:	-27.81
Dipole, Da:	2.28
IP(EA), eV:	-8.96(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-phenylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)COCCCNC/C=C/C1=CC=CC=C1

DOS

IR

Vibrations