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Complex #9016 — Au(1)

2D Structure

Structure
⬇ MOL V3000

Info

ID9016
MetalAu
Oxidation state1
Charge0
Donor atoms{"N": 6, "O": 2, "Cl": 1}
Abbreviation
SMILESCC(C)(C)c1noc(-c2ccc(-n3[c-][n+](-c4ccc(-c5nc(C(C)(C)C)no5)cc4)cc3)cc2)n1.[Cl-]

Measurements (11)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MAXF 4012.2 10.1016/j.ejmech.2015.06.053 2015
GXF 2512.3 10.1016/j.ejmech.2015.06.053 2015
MEXF 4622.5 10.1016/j.ejmech.2015.06.053 2015
RXF 4863 10.1016/j.ejmech.2015.06.053 2015
UXF-11383.4 10.1016/j.ejmech.2015.06.053 2015
LXFL 5293.9 10.1016/j.ejmech.2015.06.053 2015
PAXF 16574.3 10.1016/j.ejmech.2015.06.053 2015
PXF 17525.3 10.1016/j.ejmech.2015.06.053 2015
LXFA 6297.4 10.1016/j.ejmech.2015.06.053 2015
CXF HT-2915 10.1016/j.ejmech.2015.06.053 2015
OVXF 89920 10.1016/j.ejmech.2015.06.053 2015

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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