Geometry & MOs

Info

ID:	225359
PubChem CID:	85756511
Reduced:	FN2O3C15H15 (1)
Stoich.:	AB2C3D15E15 (1)
Weight, g/mol:	209.105193
ΔH_f, kcal/mol:	-116.7
Dipole, Da:	5.03
IP(EA), eV:	-8.18(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)NC2=CC(=CC=C2)F)OC

DOS

IR

Vibrations