Geometry & MOs

Info

ID:	67512
PubChem CID:	46506616
Reduced:	ClSN3O4C19H22 (1)
Stoich.:	ABC3D4E19F22 (1)
Weight, g/mol:	413.036768
ΔH_f, kcal/mol:	-117.58
Dipole, Da:	5.08
IP(EA), eV:	-8.35(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-2-[5-[(2-chlorophenyl)methyl]-1,1-dioxo-1,2,5-thiadiazolidin-2-yl]acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)CN2CCN(S2(=O)=O)CC3=CC=CC=C3Cl

DOS

IR

Vibrations