Geometry & MOs

Info

ID:	299364
PubChem CID:	117682736
Reduced:	NSO3C10H15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	271.099063
ΔH_f, kcal/mol:	-144.19
Dipole, Da:	4.79
IP(EA), eV:	-9.33(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(methylamino)ethyl]-3-(3-methylsulfanyl-2,5-dioxopyrrol-1-yl)propanamide

Drug info:

PubChemData

Smile

CCCCC(=O)N1C(=O)CC(C1=O)SC

DOS

IR

Vibrations