home← all complexes Ir builderC^N familiesD-MPNN

Complex #842 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID842
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation1
SMILESCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCNC(=O)CCC(=O)Nc1cc2cccnc2c2ncccc12.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C53H43ClFN11O4Ru/(1-44)(2-45)(3-49)(4-66)(5-50)(6-46)(7-48)(8-47)(9-55)(10-67)(11-71)(12-74)(13-67)(14-72)(15-66)(16-75)(17-51)(18-59)(19-76)(20-52)(21-57)(22-60)(23-54)(24-89)(25-61)(26-73)(27-64)(28-87)(29-89)(30-53)(31-58)(32-89)(33-77)(34-65)(35-77)(36-56)(37-62)(38-90)(39-90)(40-63)(41-100)(42-99)(43-101)(44-45)(44-78)(45-49)(46-47)(46-50)(47-79)(48-51)(48-52)(49-71)(50-74)(51-75)(52-80)(53-54)(53-72)(54-68)(55-69)(55-91)(56-62)(56-95)(57-68)(57-84)(58-86)(58-96)(59-60)(59-65)(60-81)(61-85)(61-92)(62-86)(63-64)(63-70)(64-73)(65-76)(66-67)(66-93)(67-94)(68-83)(69-85)(69-88)(70-82)(70-84)(71-104)(72-97)(73-98)(74-105)(75-106)(76-107)(77-90)(77-99)(78-79)(78-104)(79-105)(80-81)(80-106)(81-107)(82-83)(82-98)(83-97)(84-100)(85-103)(86-101)(87-102)(87-103)(88-101)(88-102)(89-111)(90-110)(91-92)(91-110)(92-111)(93-99)(93-108)(94-100)(94-109)(95-96)(95-112)(96-113)(102-114)(103-114)(104-114)(105-114)(106-114)(107-114)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A4317 10.1039/d3dt01661g 2023
A54927 10.1039/d3dt01661g 2023
HeLa27 10.1039/d3dt01661g 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
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.