Geometry & MOs

Info

ID:	2713
PubChem CID:	8359
Reduced:	NO3H5C8 (1)
Stoich.:	AB3C5D8 (1)
Weight, g/mol:	163.026943
ΔH_f, kcal/mol:	-94.55
Dipole, Da:	7.01
IP(EA), eV:	-9.9(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-3,1-benzoxazine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)OC(=O)N2

DOS

IR

Vibrations