Geometry & MOs

Info

ID:	242599
PubChem CID:	97857565
Reduced:	SO2F3N3C14H16 (1)
Stoich.:	AB2C3D3E14F16 (1)
Weight, g/mol:	256.215078
ΔH_f, kcal/mol:	-178.85
Dipole, Da:	6.23
IP(EA), eV:	-8.7(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3S)-1-(1,3-dioxolan-2-ylmethyl)piperidin-3-yl]methyl]-N-ethylethanamine

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C(C=C1)S(=O)(=O)C)NC2=NN(C=C2)CC(F)(F)F

DOS

IR

Vibrations