Geometry & MOs

Info

ID:	48561
PubChem CID:	11108253
Reduced:	NO2H15C17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	265.98038
ΔH_f, kcal/mol:	-25.4
Dipole, Da:	5.45
IP(EA), eV:	-8.41(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-iodocyclohex-2-en-1-yl) acetate

Drug info:

PubChemData

Smile

CN1C(=CC2=CC=CC=C2C1=O)C3=CC=CC=C3OC

DOS

IR

Vibrations