Geometry & MOs

Info

ID:	144988
PubChem CID:	53445596
Reduced:	NSO3H9C11 (1)
Stoich.:	ABC3D9E11 (1)
Weight, g/mol:	191.040485
ΔH_f, kcal/mol:	-89.9
Dipole, Da:	7.83
IP(EA), eV:	-9.3(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methylthiophen-2-yl)-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=CSC(=C1)C2=CNC(=O)C(=C2)C(=O)O

DOS

IR

Vibrations