Geometry & MOs

Info

ID:	125425
PubChem CID:	50923870
Reduced:	FON3H22C23 (1)
Stoich.:	ABC3D22E23 (1)
Weight, g/mol:	500.258754
ΔH_f, kcal/mol:	-8.25
Dipole, Da:	1.36
IP(EA), eV:	-7.74(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[[6-[(3-fluoro-4-methoxyphenyl)methyl]-1,2,3,7-tetrahydroindolo[3,2-f][1,8]naphthyridin-4-yl]methyl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN1CCCC2=C3C4=CC=CC=C4NC3=C(N=C21)CC5=CC(=C(C=C5)OC)F

DOS

IR

Vibrations