Geometry & MOs

Info

ID:	20028
PubChem CID:	577138
Reduced:	ON3F6H19C21 (1)
Stoich.:	AB3C6D19E21 (1)
Weight, g/mol:	443.143231
ΔH_f, kcal/mol:	-297.21
Dipole, Da:	5.14
IP(EA), eV:	-8.47(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1,1,1,3,3,3-hexafluoro-2-[2-(1H-indol-3-yl)ethylamino]propan-2-yl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC(C(F)(F)F)(C(F)(F)F)NCCC2=CNC3=CC=CC=C32

DOS

IR

Vibrations