Geometry & MOs

Info

ID:	271077
PubChem CID:	103642811
Reduced:	N3O4C14H15 (1)
Stoich.:	A3B4C14D15 (1)
Weight, g/mol:	268.142307
ΔH_f, kcal/mol:	-73.83
Dipole, Da:	6.5
IP(EA), eV:	-9.67(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[1-[methyl-[3-(methylamino)-3-oxopropyl]amino]ethyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC=C1OCCN2C=C(N=N2)C(=O)OC

DOS

IR

Vibrations