Geometry & MOs

Info

ID:	371770
PubChem CID:	131271597
Reduced:	NSO2F3C8H8 (1)
Stoich.:	ABC2D3E8F8 (1)
Weight, g/mol:	204.126263
ΔH_f, kcal/mol:	-214.79
Dipole, Da:	4.8
IP(EA), eV:	-10.33(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S)-1-amino-2-methylpropyl]-1H-indol-4-ol

Drug info:

PubChemData

Smile

CC(C)(C1=CC(=NS1)C(F)(F)F)C(=O)O

DOS

IR

Vibrations