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Complex #6209 — Re(1) [9]

2D Structure

Structure
⬇ MOL V3000

Info

ID6209
MetalRe
Oxidation state1
Charge0
Donor atoms{"N": 2, "O": 3}
Abbreviation9
SMILESCc1ccc(-c2ccccn2)nc1.[Br-].[C-]#[O+].[C-]#[O+].[C-]#[O+]

TUCAN

C14H10N2O3Re/(1-12)(2-11)(3-16)(4-13)(5-11)(6-11)(7-15)(8-14)(9-18)(10-19)(11-17)(12-15)(12-17)(13-14)(13-16)(14-21)(15-20)(16-19)(17-18)(18-26)(19-25)(20-21)(20-26)(21-25)(22-27)(23-28)(24-29)(25-30)(26-30)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
PANC-116— 10.1039/d2dt04041g 2023
MIA PaCa-222— 10.1039/d2dt04041g 2023
HCT-11622— 10.1039/d2dt04041g 2023
HT-291.7e+02— 10.1039/d2dt04041g 2023
MRC-5—— 10.1039/d2dt04041g 2023

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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