Geometry & MOs

Info

ID:	204022
PubChem CID:	79902088
Reduced:	FSN3O3C13H18 (1)
Stoich.:	ABC3D3E13F18 (1)
Weight, g/mol:	306.140199
ΔH_f, kcal/mol:	-140.23
Dipole, Da:	6.87
IP(EA), eV:	-8.82(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(6-oxa-2-thiaspiro[4.5]decan-9-ylamino)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1S(=O)(=O)NCCC(=O)NC2CC2)N)F

DOS

IR

Vibrations