Geometry & MOs

Info

ID:	262699
PubChem CID:	103308967
Reduced:	ON2F6H10C11 (1)
Stoich.:	AB2C6D10E11 (1)
Weight, g/mol:	329.00421
ΔH_f, kcal/mol:	-338.98
Dipole, Da:	3.73
IP(EA), eV:	-9.26(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-chloro-1H-indol-3-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-one

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN)NC(=O)C(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations