Geometry & MOs

Info

ID:	318641
PubChem CID:	126652520
Reduced:	NO4C19H19 (1)
Stoich.:	AB4C19D19 (1)
Weight, g/mol:	351.121906
ΔH_f, kcal/mol:	-122.02
Dipole, Da:	9.34
IP(EA), eV:	-8.89(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-oxopyrido[1,2-a]pyrimidine-3-carbonyl)amino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CCOC(C1=CN(C2=CC=CC=C2C1=O)CC3=CC=CC=C3O)O

DOS

IR

Vibrations