Geometry & MOs

Info

ID:	341466
PubChem CID:	127264159
Reduced:	BrN2F3H8C10 (1)
Stoich.:	AB2C3D8E10 (1)
Weight, g/mol:	244.082347
ΔH_f, kcal/mol:	-121.62
Dipole, Da:	1.96
IP(EA), eV:	-8.96(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations