home← all complexes Ir builderC^N familiesD-MPNN

Complex #529 — Ru(2) [2a]

2D Structure

Structure
⬇ MOL V3000

Info

ID529
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 1, "S": 1}
Abbreviation2a
SMILESCc1cc(C)c(-n2cc[n+](-c3c(C)cc(C)cc3C)c2C(=S)[S-])c(C)c1.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C32ClN2RuS2/(1-21)(2-18)(3-23)(4-19)(5-20)(6-24)(7-25)(8-26)(9-19)(10-13)(10-20)(11-18)(11-21)(12-18)(12-23)(13-22)(14-17)(14-22)(15-24)(15-25)(16-24)(16-26)(17-20)(19-22)(21-29)(23-29)(25-30)(26-30)(27-28)(27-33)(28-34)(29-33)(30-34)(31-32)(31-33)(31-34)(32-35)(32-36)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
K-5620.051 10.1021/acs.inorgchem.1c02648 2021
Hs6830.48 10.1007/s00775-024-02052-2 2024
A5491 10.1007/s00775-024-02052-2 2024

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
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.