Geometry & MOs

Info

ID:	77419
PubChem CID:	48429963
Reduced:	SN2O3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	362.093643
ΔH_f, kcal/mol:	-106.84
Dipole, Da:	7.1
IP(EA), eV:	-8.52(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(methanesulfonamido)-4-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)C)C)NS(=O)(=O)C

DOS

IR

Vibrations