Geometry & MOs

Info

ID:	236827
PubChem CID:	92714848
Reduced:	ClSN2O3C24H27 (1)
Stoich.:	ABC2D3E24F27 (1)
Weight, g/mol:	342.103814
ΔH_f, kcal/mol:	-125.64
Dipole, Da:	3.91
IP(EA), eV:	-8.68(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2-dihydroisoindole-5-sulfonamide

Drug info:

PubChemData

Smile

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)OCC4=C(N=C5C=C(C=CC5=C4)SC)Cl

DOS

IR

Vibrations