Geometry & MOs

Info

ID:	408104
PubChem CID:	135080860
Reduced:	OC5H6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	214.039672
ΔH_f, kcal/mol:	-42.26
Dipole, Da:	5.18
IP(EA), eV:	-8.76(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-7-ethoxybicyclo[2.2.2]oct-5-ene-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=C/C(=C/C)/C=CC1=O

DOS

IR

Vibrations