Geometry & MOs

Info

ID:	179167
PubChem CID:	76444836
Reduced:	ON2C3H7 (2)
Stoich.:	AB2C3D7 (2)
Weight, g/mol:	205.055049
ΔH_f, kcal/mol:	10.58
Dipole, Da:	6.19
IP(EA), eV:	-8.88(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-difluoro-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxazine-2,4-dione

Drug info:

PubChemData

Smile

CCCN(CC)C=NN[N+](=O)[O-]

DOS

IR

Vibrations