Geometry & MOs

Info

ID:	10550
PubChem CID:	104142
Reduced:	NO3H4C8 (2)
Stoich.:	AB3C4D8 (2)
Weight, g/mol:	324.038236
ΔH_f, kcal/mol:	-85.49
Dipole, Da:	8.08
IP(EA), eV:	-10.04(-2.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-nitro-1,2-dihydronaphtho[2,3-h][3,1]benzoxazine-4,7,12-trione

Drug info:

PubChemData

Smile

C1NC2=C3C(=C(C=C2C(=O)O1)[N+](=O)[O-])C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations