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Complex #9147 — Au(1)

2D Structure

Structure
⬇ MOL V3000

Info

ID9147
MetalAu
Oxidation state1
Charge0
Donor atoms{"O": 2, "N": 2, "F": 1, "Cl": 1}
Abbreviation
SMILESCOc1ccc(-c2c3ccc(N/[C-]=[NH+]/c4c(C)cc(C)cc4C)ccc-3c(-c3ccc(OC)cc3)c2-c2ccc(F)cc2)cc1.[Cl-]

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A27801e+02 10.1039/d5ra07020a 2025
A2780cisR1e+02 10.1039/d5ra07020a 2025
MDA-MB-2311e+02 10.1039/d5ra07020a 2025
U-87 MG1e+02 10.1039/d5ra07020a 2025

Source-assisted 2D generator

Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.

experimental validation surface
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