Geometry & MOs

Info

ID:	67638
PubChem CID:	46506874
Reduced:	SN3O5C21H25 (1)
Stoich.:	AB3C5D21E25 (1)
Weight, g/mol:	459.021118
ΔH_f, kcal/mol:	-153.52
Dipole, Da:	5.42
IP(EA), eV:	-8.46(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-1,1-dioxo-4-phenyl-1lambda6,2,3-benzothiadiazin-2-yl)-N-(4-chlorophenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)CN2CCN(S2(=O)=O)CC(=O)NC3=CC4=C(C=C3)OCO4)C

DOS

IR

Vibrations