Geometry & MOs

Info

ID:	331649
PubChem CID:	127249732
Reduced:	FON4C18H21 (1)
Stoich.:	ABC4D18E21 (1)
Weight, g/mol:	418.200491
ΔH_f, kcal/mol:	-3.61
Dipole, Da:	1.64
IP(EA), eV:	-8.73(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxyphenyl)-1-[2-[6-[(6-methylpyridin-2-yl)amino]pyridin-2-yl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

C1CC1CN2CCOC(C2)C3=NC(=CC=C3)NC4=NC=C(C=C4)F

DOS

IR

Vibrations