Geometry & MOs

Info

ID:	425364
PubChem CID:	135126065
Reduced:	BrO2H11C16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	233.116427
ΔH_f, kcal/mol:	7.64
Dipole, Da:	4.27
IP(EA), eV:	-10.05(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-(5-hydroxy-1H-indol-3-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C=C/C=O)C(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations