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Complex #1041 — Ru(2) [9b]

2D Structure

Structure
⬇ MOL V3000

Info

ID1041
MetalRu
Oxidation state2
Charge0
Donor atoms{"P": 1}
Abbreviation9b
SMILESCc1ccc(C(C)C)cc1.O=C(O)c1ccc(P(c2ccccc2)c2ccccc2)cc1.[Cl-].[Cl-]

TUCAN

C29Cl2O2PRu/(1-22)(2-24)(3-24)(4-7)(4-9)(5-8)(5-22)(6-7)(6-11)(8-25)(9-27)(10-12)(10-13)(11-27)(12-29)(13-15)(14-20)(14-28)(15-17)(16-19)(16-25)(17-29)(18-21)(18-28)(19-22)(20-23)(21-23)(23-26)(24-25)(26-30)(26-31)(27-32)(28-32)(29-32)

Measurements (9)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
CAPAN-146 10.1021/acs.inorgchem.7b01178 2017
A2780 10.1021/acs.inorgchem.7b01082 2017
A2780cisR 10.1021/acs.inorgchem.7b01082 2017
HEK293 10.1021/acs.inorgchem.7b01082 2017
BxPC-3 10.1039/c7nj02300f 2017
BALB/3T3 clone A31 10.1039/c7nj02300f 2017
PC-3 10.1021/acs.inorgchem.7b01178 2017
MCF-7 10.1021/acs.inorgchem.7b01178 2017
Caco-2 10.1021/acs.inorgchem.7b01178 2017

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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