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Complex #6300 — Re(1) [2b]

2D Structure

Structure
⬇ MOL V3000

Info

ID6300
MetalRe
Oxidation state1
Charge1
Donor atoms{"N": 3, "O": 3}
Abbreviation2b
SMILESCC1=C(C)C2C=Cc3c(ncc(C)c3C)C2N=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].c1ccncc1

TUCAN

C24H23N3O3Re/(1-31)(2-40)(3-25)(4-38)(5-27)(6-27)(7-28)(8-44)(9-30)(10-25)(11-24)(12-29)(13-26)(14-24)(15-24)(16-32)(17-41)(18-42)(19-39)(20-25)(21-27)(22-26)(23-26)(24-36)(25-34)(26-37)(27-33)(28-29)(28-32)(29-41)(30-31)(30-38)(31-35)(32-42)(33-34)(33-39)(34-35)(35-43)(36-37)(36-38)(37-40)(38-44)(39-48)(40-50)(41-49)(42-49)(43-44)(43-48)(44-50)(45-51)(46-52)(47-53)(48-54)(49-54)(50-54)

Measurements (1)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa17— 10.1002/ejic.202100364 2021

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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