Geometry & MOs

Info

ID:	290324
PubChem CID:	104429336
Reduced:	SO3N5C11H19 (1)
Stoich.:	AB3C5D11E19 (1)
Weight, g/mol:	280.153541
ΔH_f, kcal/mol:	-111.17
Dipole, Da:	4.82
IP(EA), eV:	-9.88(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-methoxyethylamino)-3-oxopropyl]-2-(methylamino)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CCNS(=O)(=O)C1=CN=C(N=C1)N

DOS

IR

Vibrations