Geometry & MOs

Info

ID:	165330
PubChem CID:	74533280
Reduced:	ClSF2N2O5H17C21 (1)
Stoich.:	ABC2D2E5F17G21 (1)
Weight, g/mol:	419.130363
ΔH_f, kcal/mol:	-251.38
Dipole, Da:	5.55
IP(EA), eV:	-9.14(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-indol-3-yl)-N-[2-[5-[(4-methylphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)OCC(=O)NCCN2C(=O)C(=CC3=CC=C(C=C3)OC(F)F)SC2=O)Cl

DOS

IR

Vibrations