Geometry & MOs

Info

ID:	36793
PubChem CID:	8012771
Reduced:	ON3C10H10 (2)
Stoich.:	AB3C10D10 (2)
Weight, g/mol:	256.082347
ΔH_f, kcal/mol:	52.49
Dipole, Da:	3.94
IP(EA), eV:	-9.27(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-indol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide

Drug info:

PubChemData

Smile

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CN3N=C(N=N3)C4=CC=CC=C4C

DOS

IR

Vibrations