Geometry & MOs

Info

ID:	129500
PubChem CID:	51072848
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	292.088164
ΔH_f, kcal/mol:	-38.07
Dipole, Da:	3.25
IP(EA), eV:	-8.88(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]acetate

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CN(C)C1=CC=CC=C1

DOS

IR

Vibrations