Geometry & MOs

Info

ID:	47834
PubChem CID:	10535531
Reduced:	OF2C3H3 (2)
Stoich.:	AB2C3D3 (2)
Weight, g/mol:	186.042927
ΔH_f, kcal/mol:	-280.6
Dipole, Da:	2.85
IP(EA), eV:	-11.41(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-oxido-8-oxa-12-aza-4-azoniatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

Drug info:

PubChemData

Smile

CCOC(=O)/C=C(/C(F)(F)F)\F

DOS

IR

Vibrations