Geometry & MOs

Info

ID:	67874
PubChem CID:	46507345
Reduced:	SN3O5H17C21 (1)
Stoich.:	AB3C5D17E21 (1)
Weight, g/mol:	389.086784
ΔH_f, kcal/mol:	-111.63
Dipole, Da:	4.15
IP(EA), eV:	-8.94(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-ethyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(2-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC(=O)O)OC4=CC=CC=C43

DOS

IR

Vibrations