Geometry & MOs

Info

ID:	152356
PubChem CID:	56311271
Reduced:	NO2C12H13 (2)
Stoich.:	AB2C12D13 (2)
Weight, g/mol:	462.263091
ΔH_f, kcal/mol:	-122.91
Dipole, Da:	3.0
IP(EA), eV:	-9.16(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[[2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC3=CC(=O)OC4=C3C=CC(=C4C)O

DOS

IR

Vibrations