Geometry & MOs

Info

ID:	345194
PubChem CID:	127268954
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	394.203862
ΔH_f, kcal/mol:	-103.4
Dipole, Da:	7.75
IP(EA), eV:	-8.53(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(4-acetylpiperazin-1-yl)phenyl]methyl]-2-methylpiperidine-1-sulfonamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)C2=CC=CC=C2CNS(=O)(=O)N3CCCCCC3

DOS

IR

Vibrations