Geometry & MOs

Info

ID:	205239
PubChem CID:	80075363
Reduced:	BrN3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	315.03711
ΔH_f, kcal/mol:	63.94
Dipole, Da:	2.61
IP(EA), eV:	-8.49(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-bromophenyl)methyl]-6-methylbenzimidazol-2-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(N2C3=C(C=CC(=C3)Br)C)N

DOS

IR

Vibrations