Geometry & MOs

Info

ID:	332924
PubChem CID:	127251348
Reduced:	FO2N5C23H24 (1)
Stoich.:	AB2C5D23E24 (1)
Weight, g/mol:	444.227374
ΔH_f, kcal/mol:	-51.35
Dipole, Da:	2.69
IP(EA), eV:	-8.96(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-(2-aminopyrimidin-5-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)NC3=CC=C(C=C3)F)C4=CN=C(C=C4)N

DOS

IR

Vibrations