Geometry & MOs

Info

ID:	421398
PubChem CID:	135115917
Reduced:	O5N8C28H40 (1)
Stoich.:	A5B8C28D40 (1)
Weight, g/mol:	272.094312
ΔH_f, kcal/mol:	-165.64
Dipole, Da:	3.38
IP(EA), eV:	-9.18(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(methanesulfonamido)ethylamino]-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)NCCCN(CC2=CN(CCCOC3=C(C=CC(=C3)C)C(=O)N1)N=N2)C(=O)CN4CCC(CC4)C(=O)N

DOS

IR

Vibrations