Geometry & MOs

Info

ID:	248730
PubChem CID:	103083999
Reduced:	BrN4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	283.97159
ΔH_f, kcal/mol:	60.71
Dipole, Da:	5.95
IP(EA), eV:	-9.16(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-methylphenyl)-5-(chloromethyl)-1H-imidazole

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C2=NNC(=N2)CCN

DOS

IR

Vibrations