Geometry & MOs

Info

ID:	22541
PubChem CID:	597607
Reduced:	NOS2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	223.012556
ΔH_f, kcal/mol:	1.27
Dipole, Da:	2.77
IP(EA), eV:	-8.79(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[1,3-dithiolane-2,2'-1H-indole]-3'-one

Drug info:

PubChemData

Smile

C1CSC2(S1)C(=O)C3=CC=CC=C3N2

DOS

IR

Vibrations