Geometry & MOs

Info

ID:	383946
PubChem CID:	134976031
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	196.084792
ΔH_f, kcal/mol:	81.79
Dipole, Da:	3.58
IP(EA), eV:	-9.47(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-nitrofuran-2-yl)piperidine

Drug info:

PubChemData

Smile

CCCCCC(/C=C/C1=CC=CC=C1)N=[N+]=[N-]

DOS

IR

Vibrations