Geometry & MOs

Info

ID:	332922
PubChem CID:	127251346
Reduced:	FO2N5C22H24 (1)
Stoich.:	AB2C5D22E24 (1)
Weight, g/mol:	422.186652
ΔH_f, kcal/mol:	-41.27
Dipole, Da:	3.37
IP(EA), eV:	-8.88(-0.35)
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]-N-(4-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)CC(=O)NC3=CC=C(C=C3)F)C4=CN(N=C4)C

DOS

IR

Vibrations