Geometry & MOs

Info

ID:	56610
PubChem CID:	17487181
Reduced:	S2O3N4C18H24 (1)
Stoich.:	A2B3C4D18E24 (1)
Weight, g/mol:	278.179442
ΔH_f, kcal/mol:	-33.04
Dipole, Da:	2.33
IP(EA), eV:	-8.99(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[(4-fluorophenyl)methyl-methylamino]propanamide

Drug info:

PubChemData

Smile

CCN1C(=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4CC4

DOS

IR

Vibrations