Geometry & MOs

Info

ID:	267286
PubChem CID:	103581627
Reduced:	BrClN2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	339.00255
ΔH_f, kcal/mol:	13.67
Dipole, Da:	3.39
IP(EA), eV:	-8.96(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[(4-bromo-3-chlorophenyl)methylamino]ethyl]phenol

Drug info:

PubChemData

Smile

CN1CCCC1CNCC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations