Geometry & MOs

Info

ID:	158335
PubChem CID:	56463434
Reduced:	ClSN3O5C20H22 (1)
Stoich.:	ABC3D5E20F22 (1)
Weight, g/mol:	408.183127
ΔH_f, kcal/mol:	-176.59
Dipole, Da:	14.41
IP(EA), eV:	-8.3(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carbonyl]piperazin-1-yl]-2-morpholin-4-ylethane-1,2-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)CCN2CCCC2=O)S(=O)(=O)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations