Geometry & MOs

Info

ID:	248732
PubChem CID:	103084006
Reduced:	BrN3C11H12 (1)
Stoich.:	AB3C11D12 (1)
Weight, g/mol:	305.05276
ΔH_f, kcal/mol:	47.6
Dipole, Da:	4.83
IP(EA), eV:	-8.89(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(4-bromo-2-methylphenyl)-1H-imidazol-5-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C2=NC=C(N2)CN

DOS

IR

Vibrations