Geometry & MOs

Info

ID:	282004
PubChem CID:	103914654
Reduced:	ON2C12H24 (1)
Stoich.:	AB2C12D24 (1)
Weight, g/mol:	240.144948
ΔH_f, kcal/mol:	-49.46
Dipole, Da:	2.25
IP(EA), eV:	-8.58(2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]propan-2-ol

Drug info:

PubChemData

Smile

C[C@@H](CNC1CCN(CC1)CC2CC2)O

DOS

IR

Vibrations