Geometry & MOs

Info

ID:	122965
PubChem CID:	50828882
Reduced:	FN3O4H14C22 (1)
Stoich.:	AB3C4D14E22 (1)
Weight, g/mol:	464.098826
ΔH_f, kcal/mol:	-45.8
Dipole, Da:	2.05
IP(EA), eV:	-8.65(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluoro-2-methylphenyl)-1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=NC(=NO4)C5=CC(=CC=C5)F

DOS

IR

Vibrations