COMPOUND RECORD :


Compound image
Export structure or image

Summary

Compound Information

FormulaC29H18F3N3O6ReS
Molecular Weight778.729
SynonymsNot available

Structure Descriptors

SMILES:[Re+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[O-]S(=O)(=O)C(F)(F)F.C1=CC=C(C=C1)C#CC1=CC=NC=C1.C1=CC2=C(N=C1)C1=C(C=CC=N1)C=C2
InChI:1S/C13H9N.C12H8N2.CHF3O3S.3CO.Re/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13;1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2-1(3,4)8(5,6)7;3*1-2;/h1-5,8-11H;1-8H;(H,5,6,7);;;;/q;;;;;;+1/p-1
InChIKey:OQKHFTDPPZQUCJ-UHFFFAOYSA-M