Geometry & MOs

Info

ID:	157746
PubChem CID:	56436906
Reduced:	ON5C24H29 (1)
Stoich.:	AB5C24D29 (1)
Weight, g/mol:	413.191483
ΔH_f, kcal/mol:	38.83
Dipole, Da:	1.96
IP(EA), eV:	-8.86(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(difluoromethoxy)naphthalen-1-yl]methyl]-1-[6-(2-methylmorpholin-4-yl)pyridin-3-yl]methanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OCC2=CC=CC=N2)C)CNC3CCN(CC3)C4=NC=CC=N4

DOS

IR

Vibrations