Geometry & MOs

Info

ID:	160973
PubChem CID:	57390405
Reduced:	F3O3N7C26H30 (1)
Stoich.:	A3B3C7D26E30 (1)
Weight, g/mol:	381.14887
ΔH_f, kcal/mol:	-169.03
Dipole, Da:	12.81
IP(EA), eV:	-9.18(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-N-[(4-fluorophenyl)methyl]-4-hydroxy-2-oxo-1,5-naphthyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NCCC(=O)N1CC[C@@H]([C@@H](C1)C2=CC=CC=C2)NCC3=C(C=CC(=C3)N4C(=NN=N4)C(F)(F)F)OC

DOS

IR

Vibrations