Geometry & MOs

Info

ID:	155427
PubChem CID:	56355133
Reduced:	SN3O4C24H27 (1)
Stoich.:	AB3C4D24E27 (1)
Weight, g/mol:	357.132471
ΔH_f, kcal/mol:	-99.33
Dipole, Da:	10.28
IP(EA), eV:	-8.08(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[ethyl(methyl)amino]phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Drug info:

PubChemData

Smile

CCN(C)C1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC3=CC=C(C=C3)C

DOS

IR

Vibrations