Geometry & MOs

Info

ID:	341498
PubChem CID:	127264191
Reduced:	NF4C13H15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	219.063776
ΔH_f, kcal/mol:	-188.16
Dipole, Da:	4.22
IP(EA), eV:	-9.68(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2,2,2-trifluoro-1-(oxan-4-yl)ethanamine;hydrochloride

Drug info:

PubChemData

Smile

C1CC(C1)[C@@H](C(F)(F)F)NCC2=CC=C(C=C2)F

DOS

IR

Vibrations