Geometry & MOs

Info

ID:	274176
PubChem CID:	103807576
Reduced:	SN2O2C14H20 (1)
Stoich.:	AB2C2D14E20 (1)
Weight, g/mol:	243.100777
ΔH_f, kcal/mol:	-74.46
Dipole, Da:	3.92
IP(EA), eV:	-8.25(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2-methylphenyl)-2-oxo-1H-pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N)NC(=O)CSCC2CCCO2

DOS

IR

Vibrations