Geometry & MOs

Info

ID:	158395
PubChem CID:	56463561
Reduced:	ClSN3O5C20H22 (1)
Stoich.:	ABC3D5E20F22 (1)
Weight, g/mol:	323.203134
ΔH_f, kcal/mol:	-171.97
Dipole, Da:	8.37
IP(EA), eV:	-8.55(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-2-(2-methylpropyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)CCN2CCCC2=O)S(=O)(=O)NC3=CC=CC=C3Cl

DOS

IR

Vibrations