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Complex #7015 — Rh(3) [Rh5]

2D Structure

Structure
⬇ MOL V3000

Info

ID7015
MetalRh
Oxidation state3
Charge1
Donor atoms{"N": 2, "F": 6}
AbbreviationRh5
SMILESCOC(=O)C(C)([N-]c1c(C(C)C)cccc1C(C)C)/C(C)=N/c1c(C(C)C)cccc1C(C)C.Cc1c(C)c(C)[c-](-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1C

TUCAN

C47H58F6N2O2Rh/(1-59)(2-60)(3-59)(4-60)(5-59)(6-61)(7-60)(8-74)(9-75)(10-61)(11-61)(12-76)(13-62)(14-94)(15-69)(16-62)(17-62)(18-63)(19-63)(20-63)(21-64)(22-64)(23-65)(24-66)(25-66)(26-66)(27-96)(28-70)(29-67)(30-102)(31-102)(32-77)(33-67)(34-67)(35-71)(36-70)(37-70)(38-102)(39-71)(40-71)(41-72)(42-72)(43-72)(44-65)(45-65)(46-95)(47-69)(48-68)(49-68)(50-68)(51-69)(52-73)(53-80)(54-81)(55-64)(56-79)(57-97)(58-78)(59-90)(60-82)(61-94)(62-94)(63-95)(64-95)(65-99)(66-96)(67-96)(68-89)(69-92)(70-101)(71-97)(72-97)(73-87)(73-88)(74-75)(74-83)(75-76)(76-84)(77-78)(77-85)(78-79)(79-93)(80-88)(80-91)(81-87)(81-91)(82-86)(82-90)(83-94)(83-98)(84-95)(84-98)(85-96)(85-100)(86-87)(86-89)(88-104)(89-92)(90-92)(91-105)(93-97)(93-100)(98-106)(99-101)(99-106)(100-107)(101-103)(101-107)(102-109)(103-108)(103-109)(104-110)(104-111)(104-112)(105-113)(105-114)(105-115)(106-116)(107-116)(109-116)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa7.1— 10.1021/acs.organomet.1c00572 2021
BEAS-2B11— 10.1021/acs.organomet.1c00572 2021
A54911— 10.1021/acs.organomet.1c00572 2021
A54913— 10.1021/acs.organomet.1c00572 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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