Geometry & MOs

Info

ID:	140237
PubChem CID:	52668588
Reduced:	SCl2O3N4C19H22 (1)
Stoich.:	AB2C3D4E19F22 (1)
Weight, g/mol:	397.120861
ΔH_f, kcal/mol:	-75.15
Dipole, Da:	3.44
IP(EA), eV:	-8.42(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]benzamide

Drug info:

PubChemData

Smile

CN(C)C1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N=CC=C3)Cl)Cl

DOS

IR

Vibrations