Geometry & MOs

Info

ID:	132122
PubChem CID:	51310714
Reduced:	O3N4C21H22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	334.200491
ΔH_f, kcal/mol:	-41.17
Dipole, Da:	7.57
IP(EA), eV:	-8.8(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-2-morpholin-4-yl-5-(3-oxo-3-piperidin-1-ylpropyl)-1H-pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=NC=C(C=C4)C#N

DOS

IR

Vibrations