Geometry & MOs

Info

ID:	371825
PubChem CID:	131273740
Reduced:	NSO2H7C11 (1)
Stoich.:	ABC2D7E11 (1)
Weight, g/mol:	224.071641
ΔH_f, kcal/mol:	-2.51
Dipole, Da:	4.28
IP(EA), eV:	-9.1(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(6-chloro-1-methylindol-3-yl)ethanol

Drug info:

PubChemData

Smile

C1=C(C(=CC2=C1SC=C2C=O)O)CC#N

DOS

IR

Vibrations