Geometry & MOs

Info

ID:	13167
PubChem CID:	222368
Reduced:	ClO2C9H9 (1)
Stoich.:	AB2C9D9 (1)
Weight, g/mol:	184.029107
ΔH_f, kcal/mol:	-74.53
Dipole, Da:	3.36
IP(EA), eV:	-9.41(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylphenyl) 2-chloroacetate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC(=O)CCl

DOS

IR

Vibrations