Geometry & MOs

Info

ID:	187864
PubChem CID:	77635687
Reduced:	BrFN3O5C39H43 (1)
Stoich.:	ABC3D5E39F43 (1)
Weight, g/mol:	262.063968
ΔH_f, kcal/mol:	-187.67
Dipole, Da:	4.11
IP(EA), eV:	-9.09(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(7-chloro-1-methyl-2,3-dihydroindol-5-yl)ethanol;hydrochloride

Drug info:

PubChemData

Smile

COC(=O)CCCC(=O)N1CC2CC(=C(C(C1)N2)C(=O)NC3(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)CCCOC6=C(C=CC(=C6)F)Br

DOS

IR

Vibrations