Geometry & MOs

Info

ID:	386261
PubChem CID:	134981227
Reduced:	CoO3C7H7 (1)
Stoich.:	AB3C7D7 (1)
Weight, g/mol:	301.98038
ΔH_f, kcal/mol:	-59.06
Dipole, Da:	3.76
IP(EA), eV:	-9.73(-4.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-(4-iodophenyl)prop-2-enyl] acetate

Drug info:

PubChemData

Smile

CC(=C)[CH2].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co]

DOS

IR

Vibrations