Geometry & MOs

Info

ID:	47799
PubChem CID:	10535382
Reduced:	O2C11H16 (1)
Stoich.:	A2B11C16 (1)
Weight, g/mol:	181.017521
ΔH_f, kcal/mol:	-45.35
Dipole, Da:	4.78
IP(EA), eV:	-10.03(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1=C2CC2CCCCC(=O)O

DOS

IR

Vibrations