Geometry & MOs

Info

ID:	152145
PubChem CID:	56311012
Reduced:	O3N6C25H34 (1)
Stoich.:	A3B6C25D34 (1)
Weight, g/mol:	486.230077
ΔH_f, kcal/mol:	-107.83
Dipole, Da:	3.06
IP(EA), eV:	-9.13(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide

Drug info:

PubChemData

Smile

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCN(CC3)C(=O)CC4=CC=CC=C4C)CC

DOS

IR

Vibrations