Geometry & MOs

Info

ID:	189321
PubChem CID:	77840378
Reduced:	SO4N5C10H13 (1)
Stoich.:	AB4C5D10E13 (1)
Weight, g/mol:	174.079313
ΔH_f, kcal/mol:	-75.61
Dipole, Da:	8.66
IP(EA), eV:	-10.68(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-4aH-1,6-naphthyridin-2-one

Drug info:

PubChemData

Smile

CC(C1C2N(C1=O)CC(S2)(CN3C=NN=N3)C(=O)O)O

DOS

IR

Vibrations