Geometry & MOs

Info

ID:

383207

PubChem CID:

134974797

Reduced:

NOS2H19C22 (1)

Stoich.:

ABC2D19E22 (1)

Weight, g/mol:

377.090807

ΔHf, kcal/mol:

72.52

Dipole, Da:

5.78

IP(EA), eV:

-8.01(-0.52)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[2-(2-phenylsulfanylcyclobuten-1-yl)phenyl]benzenesulfinamide

Drug info:

PubChemData

Smile

C1C[C@]2([C@@H]1C3=CC=CC=C3N=[S+]2(C4=CC=CC=C4)[O-])SC5=CC=CC=C5

DOS

IR

Vibrations