Geometry & MOs

Info

ID:	355845
PubChem CID:	127290697
Reduced:	N2S2O5C15H22 (1)
Stoich.:	A2B2C5D15E22 (1)
Weight, g/mol:	341.109707
ΔH_f, kcal/mol:	-180.59
Dipole, Da:	2.19
IP(EA), eV:	-9.76(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N-(oxan-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CCCOC3

DOS

IR

Vibrations