Geometry & MOs

Info

ID:	206948
PubChem CID:	80324534
Reduced:	SN3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	278.125298
ΔH_f, kcal/mol:	54.43
Dipole, Da:	1.83
IP(EA), eV:	-8.3(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(4-fluorophenyl)-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CN2C=CC3=C(C=CC=C32)CCN)C

DOS

IR

Vibrations