Geometry & MOs

Info

ID:	341989
PubChem CID:	127264682
Reduced:	BrClNOC8H9 (1)
Stoich.:	ABCDE8F9 (1)
Weight, g/mol:	205.006119
ΔH_f, kcal/mol:	-41.36
Dipole, Da:	2.87
IP(EA), eV:	-9.29(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-7-chloro-2,3-dihydro-1-benzofuran-3-amine;hydrochloride

Drug info:

PubChemData

Smile

C1[C@H](C2=C(O1)C(=CC=C2)Br)N.Cl

DOS

IR

Vibrations