Geometry & MOs

Info

ID:	22869
PubChem CID:	599304
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	260.116092
ΔH_f, kcal/mol:	-104.15
Dipole, Da:	3.51
IP(EA), eV:	-8.94(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(6-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl)propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCC1=CN=C2C=CC=C(N2C1=O)C

DOS

IR

Vibrations