Geometry & MOs

Info

ID:	8616
PubChem CID:	79576
Reduced:	ClO4C7H9 (1)
Stoich.:	AB4C7D9 (1)
Weight, g/mol:	192.018936
ΔH_f, kcal/mol:	-178.26
Dipole, Da:	2.38
IP(EA), eV:	-10.25(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-acetyloxy-2-chloroprop-2-enyl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC(C(=C)Cl)OC(=O)C

DOS

IR

Vibrations