Geometry & MOs

Info

ID:	49201
PubChem CID:	11528905
Reduced:	N3O4C11H11 (1)
Stoich.:	A3B4C11D11 (1)
Weight, g/mol:	249.080121
ΔH_f, kcal/mol:	-38.66
Dipole, Da:	5.72
IP(EA), eV:	-9.45(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclopropylethyl)-6-fluoro-3,1-benzoxazine-2,4-dione

Drug info:

PubChemData

Smile

CC(=O)OCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C=N1

DOS

IR

Vibrations