Geometry & MOs

Info

ID:	158472
PubChem CID:	56463767
Reduced:	SN4O4C21H28 (1)
Stoich.:	AB4C4D21E28 (1)
Weight, g/mol:	466.144154
ΔH_f, kcal/mol:	-73.65
Dipole, Da:	6.27
IP(EA), eV:	-9.45(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)sulfonyl-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations