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Complex #3747 — Ru(2) [[Ru(apy)(tpy)(CH3CN)] (ClO4)2 (1c)]

2D Structure

Structure
⬇ MOL V3000

Info

ID3747
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
Abbreviation[Ru(apy)(tpy)(CH3CN)] (ClO4)2 (1c)
SMILESCC#N.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(/N=N/c2ccccn2)nc1

TUCAN

C27H22N8Ru/(1-25)(2-29)(3-32)(4-40)(5-35)(6-43)(7-38)(8-36)(9-24)(10-26)(11-34)(12-23)(13-23)(14-23)(15-37)(16-31)(17-41)(18-42)(19-28)(20-30)(21-27)(22-33)(23-39)(24-25)(24-27)(25-41)(26-34)(26-42)(27-48)(28-35)(28-47)(29-30)(29-31)(30-44)(31-46)(32-36)(32-43)(33-34)(33-49)(35-38)(36-37)(37-45)(38-40)(39-50)(40-51)(41-52)(42-53)(43-55)(44-45)(44-54)(45-55)(46-47)(46-54)(47-51)(48-52)(48-56)(49-53)(49-57)(54-58)(55-58)(56-57)(56-58)(57-58)

Measurements (11)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
EVSA-T6 10.1007/s00775-008-0460-x 2009
MCF-721 10.1007/s00775-008-0460-x 2009
NCI-H22626 10.1007/s00775-008-0460-x 2009
A2780cisR28 10.1007/s00775-008-0460-x 2009
M19-MEL30 10.1007/s00775-008-0460-x 2009
A278031 10.1007/s00775-008-0460-x 2009
L1210/240 10.1007/s00775-008-0460-x 2009
L1210/070 10.1007/s00775-008-0460-x 2009
WiDr73 10.1007/s00775-008-0460-x 2009
IGROV-178 10.1007/s00775-008-0460-x 2009
A498 10.1007/s00775-008-0460-x 2009

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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