Geometry & MOs

Info

ID:	201071
PubChem CID:	79486116
Reduced:	ClNOSC16H18 (1)
Stoich.:	ABCDE16F18 (1)
Weight, g/mol:	328.083469
ΔH_f, kcal/mol:	-14.68
Dipole, Da:	5.09
IP(EA), eV:	-9.09(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC(CC1=CC=CS1)N(C)C(=O)C2=CC=C(C=C2)CCl

DOS

IR

Vibrations