Geometry & MOs

Info

ID:	22157
PubChem CID:	596110
Reduced:	ClOC11H15 (1)
Stoich.:	ABC11D15 (1)
Weight, g/mol:	198.081143
ΔH_f, kcal/mol:	-54.43
Dipole, Da:	3.66
IP(EA), eV:	-9.01(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-4-methoxy-1,3,5-trimethylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1CCl)C)OC)C

DOS

IR

Vibrations