Geometry & MOs

Info

ID:	293580
PubChem CID:	117393872
Reduced:	N2F3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	256.118733
ΔH_f, kcal/mol:	-136.4
Dipole, Da:	3.31
IP(EA), eV:	-8.95(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(trifluoromethyl)-1H-indol-4-yl]butan-1-amine

Drug info:

PubChemData

Smile

CC(CCN)C1=C2C=C(NC2=CC=C1)C(F)(F)F

DOS

IR

Vibrations