Geometry & MOs

Info

ID:	4824
PubChem CID:	12099
Reduced:	BrC8H9 (1)
Stoich.:	AB8C9 (1)
Weight, g/mol:	183.98876
ΔH_f, kcal/mol:	8.99
Dipole, Da:	2.07
IP(EA), eV:	-9.34(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(bromomethyl)-3-methylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CBr

DOS

IR

Vibrations