Geometry & MOs

Info

ID:	222743
PubChem CID:	85332266
Reduced:	SN3O5C26H37 (1)
Stoich.:	AB3C5D26E37 (1)
Weight, g/mol:	503.191249
ΔH_f, kcal/mol:	-136.71
Dipole, Da:	5.61
IP(EA), eV:	-8.51(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-2,2-dimethyl-4-[4-[3-(piperidin-1-ylmethyl)phenyl]phenyl]sulfonylthiomorpholine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCOCCN3CCN(CC3)CC(C)(C)SN=O

DOS

IR

Vibrations