Geometry & MOs

Info

ID:	332950
PubChem CID:	127251374
Reduced:	O3N6C24H26 (1)
Stoich.:	A3B6C24D26 (1)
Weight, g/mol:	420.190989
ΔH_f, kcal/mol:	-26.6
Dipole, Da:	3.48
IP(EA), eV:	-8.57(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-1-[2-[2-(6-methyl-4-pyrimidin-5-ylpyridin-2-yl)morpholin-4-yl]-2-oxoethyl]pyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)CN3C4=CC=CC=C4N(C3=O)C)C5=CN(N=C5)C

DOS

IR

Vibrations