Geometry & MOs

Info

ID:	69684
PubChem CID:	47205170
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	262.098728
ΔH_f, kcal/mol:	-15.45
Dipole, Da:	3.49
IP(EA), eV:	-9.53(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CCCC(=O)NCC1=CC(=NO1)C2=CC=CC=C2

DOS

IR

Vibrations