Geometry & MOs

Info

ID:	67472
PubChem CID:	46506536
Reduced:	ClSO2N5H22C26 (1)
Stoich.:	ABC2D5E22F26 (1)
Weight, g/mol:	441.068068
ΔH_f, kcal/mol:	28.05
Dipole, Da:	5.3
IP(EA), eV:	-8.78(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-2-[6-[(4-chlorophenyl)methyl]-1,1-dioxo-1,2,6-thiadiazinan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC2=NN3C(=O)C4=C(C=C(C=C4)C(=O)NC5=CC=C(C=C5)C(C)C)N=C3S2

DOS

IR

Vibrations