Geometry & MOs

Info

ID:	389695
PubChem CID:	134994496
Reduced:	OSC7H14 (1)
Stoich.:	ABC7D14 (1)
Weight, g/mol:	263.170771
ΔH_f, kcal/mol:	-56.62
Dipole, Da:	4.32
IP(EA), eV:	-8.13(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,2S)-1-ethylsulfanyl-1-phenylpropan-2-yl]piperidine

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@@H](S1=O)C

DOS

IR

Vibrations