Geometry & MOs

Info

ID:	28116
PubChem CID:	825685
Reduced:	N2O4H16C19 (1)
Stoich.:	A2B4C16D19 (1)
Weight, g/mol:	325.017557
ΔH_f, kcal/mol:	-56.06
Dipole, Da:	4.04
IP(EA), eV:	-8.56(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-4-chlorobenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1O)C=NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

DOS

IR

Vibrations