Geometry & MOs

Info

ID:	83065
PubChem CID:	49857085
Reduced:	NSO3H7C12 (1)
Stoich.:	ABC3D7E12 (1)
Weight, g/mol:	229.037508
ΔH_f, kcal/mol:	5.24
Dipole, Da:	4.18
IP(EA), eV:	-8.73(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-nitrodibenzofuran-4-ol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C=CC(=C3S2)O)[N+](=O)[O-]

DOS

IR

Vibrations