Geometry & MOs

Info

ID:	332972
PubChem CID:	127251396
Reduced:	FO3N5C23H24 (1)
Stoich.:	AB3C5D23E24 (1)
Weight, g/mol:	437.279075
ΔH_f, kcal/mol:	-85.72
Dipole, Da:	4.62
IP(EA), eV:	-9.18(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6-methyl-4-pyrimidin-5-ylpyridin-2-yl)morpholin-4-yl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)CCOC3=CC(=CC=C3)F)C4=CN=C(N=C4)N

DOS

IR

Vibrations