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Complex #776 — Ru(2) [Ru2]

2D Structure

Structure
⬇ MOL V3000

Info

ID776
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
AbbreviationRu2
SMILESCc1ccc2nc(-c3ccc(-c4nc5c6cccnc6c6ncccc6c5[nH]4)cc3)[nH]c2c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C47H34N10Ru/(1-35)(2-45)(3-64)(4-68)(5-44)(6-65)(7-56)(8-57)(9-38)(10-66)(11-67)(12-36)(13-46)(14-40)(15-51)(16-69)(17-39)(18-35)(19-47)(20-55)(21-48)(22-42)(23-54)(24-41)(25-49)(26-43)(27-35)(28-58)(29-37)(30-50)(31-52)(32-53)(33-84)(34-85)(35-59)(36-38)(36-64)(37-38)(37-72)(39-40)(39-65)(40-50)(41-42)(41-66)(42-52)(43-55)(43-59)(44-51)(44-63)(45-47)(45-62)(46-56)(46-61)(47-60)(48-59)(48-76)(49-54)(49-67)(50-73)(51-68)(52-74)(53-54)(53-77)(55-78)(56-69)(57-58)(57-62)(58-60)(60-81)(61-70)(61-75)(62-80)(63-71)(63-79)(64-86)(65-87)(66-88)(67-89)(68-83)(69-82)(70-71)(70-90)(71-84)(72-74)(72-86)(73-77)(73-87)(74-88)(75-79)(75-82)(76-78)(76-85)(77-89)(78-91)(79-83)(80-84)(80-90)(81-85)(81-91)(86-92)(87-92)(88-92)(89-92)(90-92)(91-92)

Measurements (1)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A549cisR453.7 10.1002/cbic.202400801 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
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