Geometry & MOs

Info

ID:	365657
PubChem CID:	127318378
Reduced:	SN3O4C17H21 (1)
Stoich.:	AB3C4D17E21 (1)
Weight, g/mol:	379.120192
ΔH_f, kcal/mol:	-79.36
Dipole, Da:	5.28
IP(EA), eV:	-9.81(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]phenyl]sulfonylmorpholine

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=NO3)C4CCOCC4

DOS

IR

Vibrations