Geometry & MOs

Info

ID:	13454
PubChem CID:	233400
Reduced:	BrC10H13 (1)
Stoich.:	AB10C13 (1)
Weight, g/mol:	212.02006
ΔH_f, kcal/mol:	-10.34
Dipole, Da:	2.15
IP(EA), eV:	-9.0(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(bromomethyl)-1,3,5-trimethylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)CBr)C

DOS

IR

Vibrations