Geometry & MOs

Info

ID:	275838
PubChem CID:	103818285
Reduced:	NH5C6 (3)
Stoich.:	AB5C6 (3)
Weight, g/mol:	335.05209
ΔH_f, kcal/mol:	89.86
Dipole, Da:	1.73
IP(EA), eV:	-8.5(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[(2,3-dimethoxyphenyl)methyl]-2-methylaniline

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)CNC3=CC4=C(C=C3)N=CC=C4)NC=C2

DOS

IR

Vibrations