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Complex #2210 — Ru(2) [4a]

2D Structure

Structure
⬇ MOL V3000

Info

ID2210
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 5, "P": 1}
Abbreviation4a
SMILESC1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.Oc1ccnc2c1ccc1c(O)ccnc12

TUCAN

C28H34N5O2PRu/(1-51)(2-43)(3-52)(4-60)(5-60)(6-35)(7-40)(8-36)(9-36)(10-39)(11-41)(12-36)(13-50)(14-55)(15-55)(16-61)(17-56)(18-45)(19-42)(20-38)(21-37)(22-37)(23-37)(24-44)(25-35)(26-61)(27-62)(28-56)(29-57)(30-35)(31-57)(32-62)(33-68)(34-69)(35-47)(36-50)(37-50)(38-44)(38-46)(39-40)(39-48)(40-47)(41-42)(41-47)(42-48)(43-51)(43-58)(44-49)(45-52)(45-59)(46-53)(46-58)(48-50)(49-54)(49-59)(51-66)(52-67)(53-54)(53-66)(54-67)(55-63)(55-65)(56-63)(56-64)(57-64)(57-65)(58-68)(59-69)(60-63)(60-70)(61-64)(61-70)(62-65)(62-70)(66-71)(67-71)(68-71)(69-71)(70-71)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
U-87 MG1.7— 10.1039/d2ra02677e 2022
LN2291.8— 10.1039/d2ra02677e 2022
T98G1.9— 10.1039/d2ra02677e 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
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