Geometry & MOs

Info

ID:	78519
PubChem CID:	49693461
Reduced:	SN3O4C19H21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	367.156577
ΔH_f, kcal/mol:	-109.1
Dipole, Da:	5.83
IP(EA), eV:	-8.78(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-N-methyl-4-(2-methyl-3-oxopiperazine-1-carbonyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C3=CC=CC=C3

DOS

IR

Vibrations