Geometry & MOs

Info

ID:	372051
PubChem CID:	131290954
Reduced:	BrOCl2H7C8 (1)
Stoich.:	ABC2D7E8 (1)
Weight, g/mol:	267.90573
ΔH_f, kcal/mol:	-32.71
Dipole, Da:	3.32
IP(EA), eV:	-9.38(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-chloro-5-(chloromethyl)-2-methoxybenzene

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1CCl)Cl)Br

DOS

IR

Vibrations