Geometry & MOs

Info

ID:	264936
PubChem CID:	103504248
Reduced:	FSN2O2C13H19 (1)
Stoich.:	ABC2D2E13F19 (1)
Weight, g/mol:	288.187149
ΔH_f, kcal/mol:	-116.13
Dipole, Da:	3.27
IP(EA), eV:	-8.81(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-propan-2-ylpiperidin-1-yl)sulfonylpropyl]cyclopropanamine

Drug info:

PubChemData

Smile

CNCCCCS(=O)(=O)N1CCC2=C1C=C(C=C2)F

DOS

IR

Vibrations