home← all complexes Ir builderC^N familiesD-MPNN

Complex #923 — Ru(2) [Ru-MI]

2D Structure

Structure
⬇ MOL V3000

Info

ID923
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 3, "O": 1}
AbbreviationRu-MI
SMILESC=C[CH2+].O=C(NCCOCCOCCN1C(=O)C=CC1=O)c1ccc([O-])c2ncccc12.c1cc[cH-]c1

TUCAN

C28H30N3O6Ru/(1-31)(2-31)(3-34)(4-43)(5-51)(6-39)(7-35)(8-41)(9-40)(10-36)(11-42)(12-48)(13-37)(14-53)(15-53)(16-44)(17-38)(18-52)(19-49)(20-54)(21-47)(22-48)(23-51)(24-54)(25-49)(26-52)(27-32)(28-32)(29-33)(30-59)(31-33)(32-33)(34-35)(34-36)(35-37)(36-38)(37-38)(39-42)(39-56)(40-41)(40-55)(41-45)(42-57)(43-44)(43-47)(44-46)(45-46)(45-58)(46-50)(47-61)(48-51)(48-60)(49-54)(49-59)(50-55)(50-61)(51-67)(52-53)(52-67)(53-66)(54-66)(55-62)(56-60)(56-63)(57-60)(57-64)(58-59)(58-65)(61-68)(66-68)(67-68)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
SK-BR-3 10.1002/ange.202202855 2022
MCF-7 10.1002/ange.202202855 2022
MDA-MB-231 10.1002/ange.202202855 2022
MCF-10A 10.1002/ange.202202855 2022

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.