Geometry & MOs

Info

ID:	179933
PubChem CID:	76558192
Reduced:	BrMgF3H8C13 (1)
Stoich.:	ABC3D8E13 (1)
Weight, g/mol:	341.06295
ΔH_f, kcal/mol:	-52.36
Dipole, Da:	4.62
IP(EA), eV:	-8.58(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

magnesium;N-benzyl-N-[(3-methylbenzene-2-id-1-yl)methyl]ethanamine;bromide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C[C-]=C(C=C2)C(F)(F)F.[Mg+2].[Br-]

DOS

IR

Vibrations