Geometry & MOs

Info

ID:	39522
PubChem CID:	8141165
Reduced:	SN2O5H18C21 (1)
Stoich.:	AB2C5D18E21 (1)
Weight, g/mol:	354.067428
ΔH_f, kcal/mol:	-99.53
Dipole, Da:	7.02
IP(EA), eV:	-8.94(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-hydroxy-5-methylbenzamide

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations