Geometry & MOs

Info

ID:	16474
PubChem CID:	470406
Reduced:	NO6H7C14 (1)
Stoich.:	AB6C7D14 (1)
Weight, g/mol:	285.027337
ΔH_f, kcal/mol:	-102.98
Dipole, Da:	3.22
IP(EA), eV:	-10.39(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-nitro-9-oxoxanthene-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1C(=O)O)OC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations