Geometry & MOs

Info

ID:	398260
PubChem CID:	135032562
Reduced:	O2F4H14C17 (1)
Stoich.:	A2B4C14D17 (1)
Weight, g/mol:	153.055169
ΔH_f, kcal/mol:	-198.61
Dipole, Da:	2.75
IP(EA), eV:	-8.52(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

6,6-dimethoxycyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C/CC2=C(C(=C(C(=C2F)F)OC)F)F

DOS

IR

Vibrations