Geometry & MOs

Info

ID:	1407
PubChem CID:	4346
Reduced:	NSO6C21H27 (1)
Stoich.:	ABC6D21E27 (1)
Weight, g/mol:	421.155909
ΔH_f, kcal/mol:	-204.08
Dipole, Da:	6.55
IP(EA), eV:	-8.61(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-diethoxyethyl)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCOC(CN(CC1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=CC=C(C=C3)C)OCC

DOS

IR

Vibrations