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Complex #3315 — Ru(2) [2]

2D Structure

Structure
⬇ MOL V3000

Info

ID3315
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation2
SMILESc1ccc2nc(-c3ccc4ccccc4n3)ccc2c1.c1ccc2nc(-c3ccc4ccccc4n3)ccc2c1.c1cnc2c(c1)ccc1cccnc12

TUCAN

C48H32N6Ru/(1-36)(2-69)(3-37)(4-49)(5-35)(6-33)(7-52)(8-43)(9-38)(10-42)(11-48)(12-34)(13-39)(14-55)(15-59)(16-46)(17-45)(18-40)(19-54)(20-44)(21-61)(22-53)(23-60)(24-51)(25-70)(26-50)(27-58)(28-47)(29-62)(30-41)(31-56)(32-57)(33-49)(33-73)(34-35)(34-64)(35-69)(36-39)(36-63)(37-45)(37-71)(38-44)(38-65)(39-45)(40-50)(40-66)(41-56)(41-67)(42-53)(42-74)(43-52)(43-75)(44-53)(46-51)(46-64)(47-58)(47-70)(48-55)(48-76)(49-63)(50-60)(51-68)(52-66)(54-57)(54-77)(55-65)(56-62)(57-67)(58-68)(59-60)(59-79)(61-62)(61-80)(63-71)(64-72)(65-74)(66-79)(67-80)(68-78)(69-81)(70-85)(71-82)(72-78)(72-81)(73-75)(73-82)(74-83)(75-84)(76-77)(76-83)(77-86)(78-85)(79-84)(80-86)(81-87)(82-87)(83-87)(84-87)(85-87)(86-87)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HL60472.4 10.1039/c2cc33359g 2012
HL60474.5 10.1039/c2cc33359g 2012
HL60472.3 10.1039/c2cc33359g 2012
HL60475.1 10.1039/c2cc33359g 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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