Geometry & MOs

Info

ID:

138066

PubChem CID:

52305538

Reduced:

SN3O5H14C17 (1)

Stoich.:

AB3C5D14E17 (1)

Weight, g/mol:

373.073242

ΔHf, kcal/mol:

-76.1

Dipole, Da:

2.27

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.788276

Charge, e:

 0

Chem-info

IUPAC name:

N-(benzenesulfonyl)-2-[(2,5-dioxoimidazolidin-1-yl)methyl]benzamide

Drug info:

PubChemData

Smile

C1C(=O)N(C(=O)N1)CC2=CC=CC=C2C(=NS(=O)(=O)C3=CC=CC=C3)[O-]

DOS

IR

Vibrations