Geometry & MOs

Info

ID:	55847
PubChem CID:	17396661
Reduced:	N3O6C18H19 (1)
Stoich.:	A3B6C18D19 (1)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-191.33
Dipole, Da:	5.73
IP(EA), eV:	-8.79(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopentylcarbamoyl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NC2=CC(=CC(=C2)OC)OC)C3=CC=CO3

DOS

IR

Vibrations