Geometry & MOs

Info

ID:	158304
PubChem CID:	56463326
Reduced:	O2N5C26H35 (1)
Stoich.:	A2B5C26D35 (1)
Weight, g/mol:	472.250812
ΔH_f, kcal/mol:	-43.7
Dipole, Da:	6.46
IP(EA), eV:	-8.7(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylpiperazin-1-yl)-1-phenylethyl]-3-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations