Geometry & MOs

Info

ID:	350921
PubChem CID:	127279209
Reduced:	ClFON5C18H21 (1)
Stoich.:	ABCD5E18F21 (1)
Weight, g/mol:	378.299476
ΔH_f, kcal/mol:	-6.83
Dipole, Da:	10.79
IP(EA), eV:	-9.14(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-[2-[(4-methylcyclohexyl)amino]-2-oxoethyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=NN=C(N1C2CC2)CN3CCN(CC3)C(=O)C4=C(C=CC=C4Cl)F

DOS

IR

Vibrations