Geometry & MOs

Info

ID:	37708
PubChem CID:	8023479
Reduced:	ClSO2N4H17C20 (1)
Stoich.:	ABC2D4E17F20 (1)
Weight, g/mol:	398.091198
ΔH_f, kcal/mol:	4.6
Dipole, Da:	2.91
IP(EA), eV:	-9.34(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-5-yl)-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CSC(=N1)N(C2=CC=C(C=C2)Cl)C(=O)CC3=NNC(=O)C4=CC=CC=C43

DOS

IR

Vibrations