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Complex #1753 — Ru(2) [2b]

2D Structure

Structure
⬇ MOL V3000

Info

ID1753
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 3, "P": 1, "O": 1}
Abbreviation2b
SMILESC1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.O=C(/C=C(\[O-])c1ccc2ccccc2c1)C(F)(F)F

TUCAN

C30F3N3O2PRu/(1-18)(2-20)(3-18)(4-25)(4-26)(5-7)(5-11)(6-7)(6-16)(8-9)(8-21)(9-16)(10-12)(10-17)(11-19)(12-20)(13-14)(13-17)(14-20)(15-19)(15-21)(16-19)(17-18)(21-26)(22-31)(22-32)(23-31)(23-33)(24-32)(24-33)(25-27)(25-34)(26-35)(27-36)(27-37)(27-38)(28-31)(28-39)(29-32)(29-39)(30-33)(30-39)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
CH-127— 10.1021/acs.jmedchem.5b00288 2015
MG-6332— 10.1021/acs.jmedchem.5b00288 2015

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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