Geometry & MOs

Info

ID:	341499
PubChem CID:	127264192
Reduced:	ClNOF3C7H13 (1)
Stoich.:	ABCD3E7F13 (1)
Weight, g/mol:	219.063776
ΔH_f, kcal/mol:	-250.69
Dipole, Da:	4.18
IP(EA), eV:	-9.94(1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COCCC1[C@@H](C(F)(F)F)N.Cl

DOS

IR

Vibrations