Geometry & MOs

Info

ID:	351818
PubChem CID:	127282218
Reduced:	O2N3C23H33 (1)
Stoich.:	A2B3C23D33 (1)
Weight, g/mol:	360.216141
ΔH_f, kcal/mol:	-100.02
Dipole, Da:	4.92
IP(EA), eV:	-8.96(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-[2-(2-oxopyridin-1-yl)acetyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)CC3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations