Geometry & MOs

Info

ID:	341454
PubChem CID:	127264147
Reduced:	ON2F3C11H11 (1)
Stoich.:	AB2C3D11E11 (1)
Weight, g/mol:	244.082347
ΔH_f, kcal/mol:	-162.71
Dipole, Da:	7.0
IP(EA), eV:	-8.52(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2,2,2-trifluoro-1-(6-methoxy-1H-indol-3-yl)ethanamine

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC=C2[C@@H](C(F)(F)F)N

DOS

IR

Vibrations