Geometry & MOs

Info

ID:	158222
PubChem CID:	56463183
Reduced:	O2N5C23H29 (1)
Stoich.:	A2B5C23D29 (1)
Weight, g/mol:	484.160283
ΔH_f, kcal/mol:	-30.84
Dipole, Da:	5.29
IP(EA), eV:	-8.31(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylpiperazin-1-yl)-1-phenylethyl]-3-(thiophen-2-ylsulfonylamino)benzamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N(CC(=O)N4)C

DOS

IR

Vibrations