Geometry & MOs

Info

ID:	36914
PubChem CID:	8014698
Reduced:	SN3O5C16H19 (1)
Stoich.:	AB3C5D16E19 (1)
Weight, g/mol:	394.131091
ΔH_f, kcal/mol:	-177.92
Dipole, Da:	7.91
IP(EA), eV:	-10.06(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CN1CC(=O)N(C1=O)CC(=O)N([C@H]2CCS(=O)(=O)C2)C3=CC=CC=C3

DOS

IR

Vibrations