Geometry & MOs

Info

ID:	387843
PubChem CID:	134987115
Reduced:	N3O3H7C9 (1)
Stoich.:	A3B3C7D9 (1)
Weight, g/mol:	265.052112
ΔH_f, kcal/mol:	-52.31
Dipole, Da:	1.34
IP(EA), eV:	-9.84(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-methylsulfanyl-8-oxo-5H-pyrido[2,3-b]pyrazine-7-carboxylate

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C=CC=N2)C(=N1)C(=O)O

DOS

IR

Vibrations