Geometry & MOs

Info

ID:	171350
PubChem CID:	75365755
Reduced:	FNOC9H9 (2)
Stoich.:	ABCD9E9 (2)
Weight, g/mol:	318.134383
ΔH_f, kcal/mol:	-120.31
Dipole, Da:	2.67
IP(EA), eV:	-8.59(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-1H-indol-3-yl)-2-[3-(trifluoromethyl)phenyl]ethanamine

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=C(C=C2)F)C(C3=CC=C(C=C3)F)C(=O)O

DOS

IR

Vibrations