Geometry & MOs

Info

ID:	63049
PubChem CID:	26738229
Reduced:	FSO3H13C18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	372.033541
ΔH_f, kcal/mol:	-100.49
Dipole, Da:	1.91
IP(EA), eV:	-8.97(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methylphenyl)-4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)/C=C/2\CSC3=C(C2=O)C=CC=C3F

DOS

IR

Vibrations