Geometry & MOs

Info

ID:	332925
PubChem CID:	127251349
Reduced:	O2N6C25H28 (1)
Stoich.:	A2B6C25D28 (1)
Weight, g/mol:	443.232125
ΔH_f, kcal/mol:	6.84
Dipole, Da:	6.51
IP(EA), eV:	-8.78(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-(6-aminopyridin-3-yl)-6-methylpyridin-2-yl]morpholin-4-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)CC(=O)N3CCCC4=CC=CC=C43)C5=CN=C(N=C5)N

DOS

IR

Vibrations