Geometry & MOs

Info

ID:	270899
PubChem CID:	103638625
Reduced:	ClO2N3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	293.038961
ΔH_f, kcal/mol:	-83.63
Dipole, Da:	4.77
IP(EA), eV:	-9.33(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-chloro-N-(2-methylsulfanylphenyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)COCCCNC(=O)C1=CC(=NC(=C1)Cl)N

DOS

IR

Vibrations