Geometry & MOs

Info

ID:	264631
PubChem CID:	103478139
Reduced:	BrClNOC13H13 (1)
Stoich.:	ABCDE13F13 (1)
Weight, g/mol:	354.99747
ΔH_f, kcal/mol:	-3.73
Dipole, Da:	4.03
IP(EA), eV:	-8.64(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C1=CC=CO1)NC2=C(C(=CC=C2)Cl)Br

DOS

IR

Vibrations