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Complex #4559 — Ru(2) [1g]

2D Structure

Structure
⬇ MOL V3000

Info

ID4559
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 2, "O": 1}
Abbreviation1g
SMILESC1COCCN1.Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21

TUCAN

C31N2O4Ru/(1-23)(2-20)(3-23)(4-7)(4-18)(5-7)(5-12)(6-13)(6-17)(8-10)(8-20)(9-16)(9-20)(10-19)(11-15)(11-21)(12-14)(13-15)(14-18)(16-19)(17-21)(17-29)(18-25)(19-23)(21-30)(22-29)(22-30)(22-31)(24-27)(24-33)(25-32)(26-28)(26-33)(27-37)(28-37)(29-34)(30-35)(31-32)(31-36)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
SW4809.2— 10.3390/molecules24132373 2019
CH1/PA-112— 10.3390/molecules24132373 2019
A54919— 10.3390/molecules24132373 2019
HCT-11624— 10.3390/molecules24132373 2019

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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