Geometry & MOs

Info

ID:	372018
PubChem CID:	131286674
Reduced:	BrCl2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	279.94212
ΔH_f, kcal/mol:	-16.84
Dipole, Da:	2.42
IP(EA), eV:	-9.68(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(bromomethyl)-2-chloro-1-(3-chloropropyl)benzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CCCCl)CBr

DOS

IR

Vibrations