Geometry & MOs

Info

ID:	333931
PubChem CID:	127252483
Reduced:	FSN2O3C14H17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-161.8
Dipole, Da:	4.7
IP(EA), eV:	-9.93(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[7-(pyridin-3-ylmethyl)-6-oxa-2-azaspiro[3.4]octan-2-yl]ethanone

Drug info:

PubChemData

Smile

C[C@]12CCN([C@H]1CCC(=O)N2)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations