Geometry & MOs

Info

ID:	299751
PubChem CID:	117689157
Reduced:	FN5O5C19H20 (1)
Stoich.:	AB5C5D19E20 (1)
Weight, g/mol:	390.205576
ΔH_f, kcal/mol:	-4.56
Dipole, Da:	8.55
IP(EA), eV:	-8.89(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1S,2S)-2-(5-methoxypyridin-2-yl)cyclopropyl]methoxy]-3-piperidin-3-yl-1,5-naphthyridine

Drug info:

PubChemData

Smile

C[N+]1(COC(=N1)C2CCN(CC2)C3=C(C=C(C=C3)N=CC4=CC=C(O4)[N+](=O)[O-])F)[O-]

DOS

IR

Vibrations