Geometry & MOs

Info

ID:	54923
PubChem CID:	17389546
Reduced:	BrCl2N2C6H7 (1)
Stoich.:	AB2C2D6E7 (1)
Weight, g/mol:	272.108026
ΔH_f, kcal/mol:	3.61
Dipole, Da:	3.21
IP(EA), eV:	-9.11(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(1H-indol-2-yl)-2-phenylethanamine;hydrochloride

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NN)Cl)Br.Cl

DOS

IR

Vibrations