Geometry & MOs

Info

ID:	351709
PubChem CID:	127282109
Reduced:	O4N5C18H27 (1)
Stoich.:	A4B5C18D27 (1)
Weight, g/mol:	351.252192
ΔH_f, kcal/mol:	-179.04
Dipole, Da:	3.86
IP(EA), eV:	-8.8(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-[3-(oxolan-2-yl)propanoyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CN(C(=O)NC3=O)C

DOS

IR

Vibrations