Geometry & MOs

Info

ID:	58774
PubChem CID:	24714845
Reduced:	OSN2C15H18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	288.129634
ΔH_f, kcal/mol:	28.53
Dipole, Da:	2.44
IP(EA), eV:	-9.02(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(2,3-dimethylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC2=NC(=CS2)CNC3CC3

DOS

IR

Vibrations