Geometry & MOs

Info

ID:	275815
PubChem CID:	103818068
Reduced:	SF2N2O2C16H22 (1)
Stoich.:	AB2C2D2E16F22 (1)
Weight, g/mol:	290.103083
ΔH_f, kcal/mol:	-198.11
Dipole, Da:	3.62
IP(EA), eV:	-8.85(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-indol-7-ylmethyl)-3-(trifluoromethyl)aniline

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(C1)NC2=CC=C(C=C2)SC(F)F

DOS

IR

Vibrations