Geometry & MOs

Info

ID:	21171
PubChem CID:	587420
Reduced:	ClC4H4 (2)
Stoich.:	AB4C4 (2)
Weight, g/mol:	174.000306
ΔH_f, kcal/mol:	-6.13
Dipole, Da:	3.11
IP(EA), eV:	-9.59(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(dichloromethyl)-3-methylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(Cl)Cl

DOS

IR

Vibrations