Geometry & MOs

Info

ID:	341506
PubChem CID:	127264199
Reduced:	BrClNOC12H15 (1)
Stoich.:	ABCDE12F15 (1)
Weight, g/mol:	262.91711
ΔH_f, kcal/mol:	-59.93
Dipole, Da:	2.5
IP(EA), eV:	-8.75(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-benzothiophen-2-amine;hydrochloride

Drug info:

PubChemData

Smile

C1COCCC12CNC3=C2C=C(C=C3)Br.Cl

DOS

IR

Vibrations