Geometry & MOs

Info

ID:	4683
PubChem CID:	11865
Reduced:	NH3O3C4 (1)
Stoich.:	AB3C3D4 (1)
Weight, g/mol:	113.011293
ΔH_f, kcal/mol:	-4.33
Dipole, Da:	5.08
IP(EA), eV:	-10.64(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitrofuran

Drug info:

PubChemData

Smile

C1=COC(=C1)[N+](=O)[O-]

DOS

IR

Vibrations