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Complex #519 — Ru(2) [3a]

2D Structure

Structure
⬇ MOL V3000

Info

ID519
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1}
Abbreviation3a
SMILESCc1ccc(C(C)C)cc1.O=c1c([O-])c(-c2ccccc2)oc2ccccc12.[Cl-]

TUCAN

C25ClO3Ru/(1-18)(2-20)(3-20)(4-7)(4-19)(5-6)(5-12)(6-17)(7-18)(8-10)(8-11)(9-16)(9-17)(10-15)(11-24)(12-16)(13-14)(13-18)(14-19)(15-21)(17-25)(19-20)(21-23)(21-24)(22-23)(22-25)(22-27)(23-26)(24-28)(25-28)

Measurements (9)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
CH-12.1 10.1021/jm301376a 2012
CH-12.1 10.1039/C2CC31040F 2012
SW4809.6 10.1021/jm301376a 2012
SW4809.6 10.1039/C2CC31040F 2012
563711 10.1021/jm301376a 2012
DAN-G12 10.1021/jm301376a 2012
LCLC-103H13 10.1021/jm301376a 2012
A54920 10.1021/jm301376a 2012
A54920 10.1039/C2CC31040F 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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