Geometry & MOs

Info

ID:	156831
PubChem CID:	56394592
Reduced:	ClSN3O5C23H28 (1)
Stoich.:	ABC3D5E23F28 (1)
Weight, g/mol:	421.200156
ΔH_f, kcal/mol:	-163.27
Dipole, Da:	5.41
IP(EA), eV:	-8.69(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-dioxoisoindol-2-yl)-N-[1-(4-methoxyphenyl)piperidin-4-yl]butanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CCC(CC2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

DOS

IR

Vibrations