Geometry & MOs

Info

ID:	365243
PubChem CID:	127317588
Reduced:	SN2O4C16H20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	317.119798
ΔH_f, kcal/mol:	-141.05
Dipole, Da:	4.76
IP(EA), eV:	-8.5(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-4-oxo-N-(thian-4-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CSCCC1CNC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations