Geometry & MOs

Info

ID:	149680
PubChem CID:	53789354
Reduced:	SN2O2H16C17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	141.042593
ΔH_f, kcal/mol:	-4.53
Dipole, Da:	3.28
IP(EA), eV:	-9.28(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-3,4-dihydro-1H-pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CN(C(=O)C1=CC=CC=C1)C(=NC(=O)C2=CC=CC=C2)SC

DOS

IR

Vibrations