Geometry & MOs

Info

ID:	144986
PubChem CID:	53445594
Reduced:	OSN2H8C9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	235.030314
ΔH_f, kcal/mol:	9.72
Dipole, Da:	5.83
IP(EA), eV:	-9.21(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methylthiophen-2-yl)-2-oxo-1H-pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C2=CNC(=O)N=C2

DOS

IR

Vibrations