Geometry & MOs

Info

ID:	373097
PubChem CID:	131309903
Reduced:	ClON2F3C8H8 (1)
Stoich.:	ABC2D3E8F8 (1)
Weight, g/mol:	298.99327
ΔH_f, kcal/mol:	-201.48
Dipole, Da:	4.82
IP(EA), eV:	-9.22(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(5-bromo-2-fluoro-3-methylphenyl)-3,3,3-trifluoropropan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1CCl)OC(F)(F)F)N

DOS

IR

Vibrations