Geometry & MOs

Info

ID:	67902
PubChem CID:	46507388
Reduced:	SN2O5C26H28 (1)
Stoich.:	AB2C5D26E28 (1)
Weight, g/mol:	433.076613
ΔH_f, kcal/mol:	-137.75
Dipole, Da:	3.35
IP(EA), eV:	-8.4(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-ethyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3S(=O)(=O)N(C2=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations