Geometry & MOs

Info

ID:	412743
PubChem CID:	135085657
Reduced:	N2C13H20 (1)
Stoich.:	A2B13C20 (1)
Weight, g/mol:	227.061614
ΔH_f, kcal/mol:	36.08
Dipole, Da:	3.0
IP(EA), eV:	-9.07(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-ethyl-5-oxido-4,6-dihydrothieno[2,3-c]pyrrol-5-ium-2-carboxylate

Drug info:

PubChemData

Smile

C=CCNCCCNCC1=CC=CC=C1

DOS

IR

Vibrations