Geometry & MOs

Info

ID:	2518
PubChem CID:	7805
Reduced:	BrC7H7 (1)
Stoich.:	AB7C7 (1)
Weight, g/mol:	169.97311
ΔH_f, kcal/mol:	15.52
Dipole, Da:	2.56
IP(EA), eV:	-9.32(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-4-methylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)Br

DOS

IR

Vibrations