Geometry & MOs

Info

ID:	323519
PubChem CID:	126675173
Reduced:	OSN4C23H30 (1)
Stoich.:	ABC4D23E30 (1)
Weight, g/mol:	390.210742
ΔH_f, kcal/mol:	31.02
Dipole, Da:	3.44
IP(EA), eV:	-8.62(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluoro-4-phenylmethoxyphenyl)-6-(2-methylpropyl)-7,8-dihydro-5H-1,6-naphthyridine

Drug info:

PubChemData

Smile

CC1=NC=CC(=C1)N2CCN(S2)CCCCCCC3=CC4=C(C=C3)/C(=N/O)/CC4

DOS

IR

Vibrations