Geometry & MOs

Info

ID:	383208
PubChem CID:	134974799
Reduced:	NOS2H19C22 (1)
Stoich.:	ABC2D19E22 (1)
Weight, g/mol:	378.098632
ΔH_f, kcal/mol:	88.72
Dipole, Da:	4.03
IP(EA), eV:	-8.27(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2S)-2-[2-(benzenesulfinamido)phenyl]cyclobutylidene]-phenylsulfanium

Drug info:

PubChemData

Smile

C1CC(=C1C2=CC=CC=C2NS(=O)C3=CC=CC=C3)SC4=CC=CC=C4

DOS

IR

Vibrations