Geometry & MOs

Info

ID:	5625
PubChem CID:	13410
Reduced:	ClO2H7C8 (1)
Stoich.:	AB2C7D8 (1)
Weight, g/mol:	170.013457
ΔH_f, kcal/mol:	-73.74
Dipole, Da:	3.35
IP(EA), eV:	-9.29(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=C(C=C1)Cl

DOS

IR

Vibrations