home← all complexes Ir builderC^N familiesD-MPNN

Complex #2318 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID2318
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1, "N": 1}
Abbreviation1
SMILESCc1ccc(C(C)C)cc1.O=C([O-])c1ccccn1.[Cl-]

TUCAN

C16ClNO2Ru/(1-13)(2-12)(3-13)(4-5)(4-12)(5-11)(6-10)(6-15)(7-10)(7-14)(8-9)(8-11)(9-12)(11-13)(14-17)(15-16)(15-17)(16-18)(16-19)

Measurements (8)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A2780cisR36— 10.1039/b918902e 2009
A278042— 10.1039/b918902e 2009
MCF-760— 10.1039/b918902e 2009
LoVo78— 10.1039/b918902e 2009
MS178— 10.1016/j.jinorgbio.2011.12.00... 2012
EA.hy92688— 10.1016/j.jinorgbio.2011.12.00... 2012
EA.hy92695— 10.1016/j.jinorgbio.2011.12.00... 2012
MS11.1e+02— 10.1016/j.jinorgbio.2011.12.00... 2012

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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