Geometry & MOs

Info

ID:	236193
PubChem CID:	92711887
Reduced:	SN3O3C16H17 (1)
Stoich.:	AB3C3D16E17 (1)
Weight, g/mol:	331.099063
ΔH_f, kcal/mol:	-76.54
Dipole, Da:	3.56
IP(EA), eV:	-8.64(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(4-ethylphenyl)-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)[C@@H]2NC3=CC=CC=C3S(=O)(=O)N2

DOS

IR

Vibrations