Geometry & MOs

Info

ID:	16953
PubChem CID:	480983
Reduced:	SCl2N2O3H16C21 (1)
Stoich.:	AB2C2D3E16F21 (1)
Weight, g/mol:	446.025869
ΔH_f, kcal/mol:	-41.82
Dipole, Da:	5.03
IP(EA), eV:	-9.27(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,4-dichlorophenyl)methyl]-4-phenylmethoxy-2lambda6,1,3-benzothiadiazine 2,2-dioxide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=NS(=O)(=O)N(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl

DOS

IR

Vibrations