Geometry & MOs

Info

ID:	307471
PubChem CID:	125307107
Reduced:	ClSN2O3H15C19 (1)
Stoich.:	ABC2D3E15F19 (1)
Weight, g/mol:	452.115441
ΔH_f, kcal/mol:	-10.42
Dipole, Da:	4.39
IP(EA), eV:	-8.74(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3S,3'aS,8'aS,8'bS)-1',2,3'-trioxospiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-2'-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C2=NC(=S)[C@H]3CC4=C(C=CC(=C4)Cl)OC3=N2)OC

DOS

IR

Vibrations