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Complex #4 — Ru(2) [1b]

2D Structure

Structure
⬇ MOL V3000

Info

ID4
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 4, "P": 1}
Abbreviation1b
SMILESC1N2CN3CN1CP(C2)C3.[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1cnn([BH-](n2cccn2)n2cccn2)c1

TUCAN

C33H37BN9P2Ru/(1-38)(2-57)(3-39)(4-58)(5-41)(6-42)(7-60)(8-43)(9-44)(10-46)(11-45)(12-47)(13-48)(14-56)(15-49)(16-50)(17-52)(18-69)(19-69)(20-63)(21-63)(22-64)(23-70)(24-51)(25-40)(26-62)(27-53)(28-54)(29-61)(30-59)(31-55)(32-64)(33-70)(34-65)(35-71)(36-65)(37-71)(38-76)(38-77)(38-78)(39-57)(39-58)(40-60)(40-61)(41-42)(41-45)(42-43)(43-66)(44-45)(44-66)(46-48)(46-67)(47-48)(47-49)(49-50)(50-67)(51-52)(51-68)(52-56)(53-59)(53-62)(54-55)(54-68)(55-56)(57-79)(58-77)(59-78)(60-75)(61-76)(62-80)(63-72)(63-74)(64-72)(64-73)(65-73)(65-74)(66-81)(67-81)(68-81)(69-72)(69-82)(70-73)(70-82)(71-74)(71-82)(75-76)(77-79)(78-80)(79-83)(80-83)(81-83)(82-83)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-711 10.1039/C0DT00206B 2010
HUVEC25 10.1039/C0DT00206B 2010
NCI-H46027 10.1039/C0DT00206B 2010
SF-26828 10.1039/C0DT00206B 2010

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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