Geometry & MOs

Info

ID:	271837
PubChem CID:	103693794
Reduced:	F3O3H7C13 (1)
Stoich.:	A3B3C7D13 (1)
Weight, g/mol:	237.053212
ΔH_f, kcal/mol:	-215.86
Dipole, Da:	7.43
IP(EA), eV:	-10.03(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-chloro-2-methylphenyl)-3,3,3-trifluoropropan-1-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C2=C(C(=C(C=C2)F)F)F)C(=O)O)O

DOS

IR

Vibrations