Geometry & MOs

Info

ID:	262447
PubChem CID:	103293336
Reduced:	ClSO3N4C12H13 (1)
Stoich.:	ABC3D4E12F13 (1)
Weight, g/mol:	305.093104
ΔH_f, kcal/mol:	-58.39
Dipole, Da:	8.01
IP(EA), eV:	-9.33(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chloro-6-methoxyphenyl)methyl]-2-(methylamino)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)Cl)CNS(=O)(=O)C2=CN=C(N=C2)N

DOS

IR

Vibrations