Geometry & MOs

Info

ID:	61138
PubChem CID:	26706034
Reduced:	ClSN3O4C21H22 (1)
Stoich.:	ABC3D4E21F22 (1)
Weight, g/mol:	382.135114
ΔH_f, kcal/mol:	-114.68
Dipole, Da:	7.43
IP(EA), eV:	-9.44(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-diethoxyphenyl)-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(=NCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CC4=C(O3)C=CC(=C4)Cl

DOS

IR

Vibrations