Geometry & MOs

Info

ID:	332927
PubChem CID:	127251351
Reduced:	O2N5C24H33 (1)
Stoich.:	A2B5C24D33 (1)
Weight, g/mol:	422.186652
ΔH_f, kcal/mol:	-45.74
Dipole, Da:	7.27
IP(EA), eV:	-8.71(-0.16)
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-(2-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)CC(=O)N(C)C3CCCCC3)C4=CN=C(C=C4)N

DOS

IR

Vibrations