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Complex #2745 — Ru(2) [RuC9]

2D Structure

Structure
⬇ MOL V3000

Info

ID2745
MetalRu
Oxidation state2
Charge8
Donor atoms{"N": 6}
AbbreviationRuC9
SMILESc1ccc([P+](CCCCCCCCCOCc2ccnc(-c3cc(COCCCCCCCCC[P+](c4ccccc4)(c4ccccc4)c4ccccc4)ccn3)c2)(c2ccccc2)c2ccccc2)cc1.c1ccc([P+](CCCCCCCCCOCc2ccnc(-c3cc(COCCCCCCCCC[P+](c4ccccc4)(c4ccccc4)c4ccccc4)ccn3)c2)(c2...

TUCAN

C198H228N6O6P6Ru/(1-233)(2-241)(3-235)(4-236)(5-333)(6-403)(7-392)(8-229)(9-336)(10-333)(11-237)(12-336)(13-240)(14-392)(15-391)(16-238)(17-337)(18-339)(19-234)(20-394)(21-242)(22-349)(23-243)(24-239)(25-249)(26-394)(27-244)(28-230)(29-231)(30-396)(31-248)(32-252)(33-250)(34-391)(35-251)(36-232)(37-335)(38-379)(39-254)(40-258)(41-255)(42-380)(43-245)(44-259)(45-257)(46-246)(47-260)(48-263)(49-393)(50-337)(51-331)(52-262)(53-266)(54-347)(55-347)(56-247)(57-264)(58-270)(59-267)(60-268)(61-274)(62-349)(63-352)(64-253)(65-381)(66-331)(67-403)(68-271)(69-396)(70-397)(71-393)(72-395)(73-332)(74-397)(75-399)(76-284)(77-382)(78-395)(79-398)(80-272)(81-277)(82-279)(83-334)(84-276)(85-312)(86-278)(87-332)(88-350)(89-280)(90-335)(91-273)(92-398)(93-338)(94-282)(95-346)(96-338)(97-256)(98-383)(99-261)(100-334)(101-285)(102-265)(103-346)(104-339)(105-351)(106-288)(107-350)(108-343)(109-356)(110-283)(111-352)(112-340)(113-354)(114-286)(115-348)(116-289)(117-269)(118-292)(119-290)(120-341)(121-293)(122-291)(123-404)(124-341)(125-404)(126-275)(127-342)(128-405)(129-294)(130-306)(131-295)(132-348)(133-353)(134-297)(135-281)(136-296)(137-298)(138-287)(139-299)(140-302)(141-300)(142-340)(143-344)(144-304)(145-303)(146-308)(147-310)(148-353)(149-354)(150-358)(151-356)(152-357)(153-351)(154-343)(155-344)(156-361)(157-360)(158-345)(159-361)(160-360)(161-405)(162-313)(163-367)(164-328)(165-311)(166-400)(167-355)(168-320)(169-362)(170-314)(171-342)(172-345)(173-301)(174-406)(175-400)(176-305)(177-399)(178-367)(179-317)(180-355)(181-370)(182-358)(183-370)(184-357)(185-401)(186-366)(187-401)(188-364)(189-318)(190-402)(191-364)(192-402)(193-307)(194-384)(195-366)(196-325)(197-309)(198-406)(199-368)(200-362)(201-368)(202-359)(203-369)(204-363)(205-369)(206-363)(207-359)(208-323)(209-315)(210-372)(211-372)(212-407)(213-407)(214-316)(215-319)(216-324)(217-326)(218-365)(219-365)(220-371)(221-371)(222-321)(223-327)(224-408)(225-322)(226-329)(227-330)(228-408)(229-235)(229-409)(230-235)(230-236)(231-237)(231-238)(232-239)(232-244)(233-373)(233-385)(234-236)(234-409)(237-242)(238-243)(239-249)(240-374)(240-386)(241-373)(241-379)(242-410)(243-410)(244-250)(245-248)(245-252)(246-374)(246-380)(247-255)(247-257)(248-251)(249-411)(250-411)(251-412)(252-254)(253-375)(253-387)(254-412)(255-258)(256-262)(256-264)(257-259)(258-413)(259-413)(260-262)(260-414)(261-270)(261-272)(263-264)(263-414)(265-276)(265-278)(266-270)(266-415)(267-272)(267-415)(268-276)(268-416)(269-280)(269-282)(271-375)(271-381)(273-376)(273-382)(274-278)(274-416)(275-285)(275-288)(277-280)(277-417)(279-282)(279-417)(281-290)(281-291)(283-285)(283-418)(284-376)(284-388)(286-288)(286-418)(287-297)(287-298)(289-290)(289-419)(291-292)(292-419)(293-297)(293-420)(294-298)(294-420)(295-299)(295-421)(296-302)(296-421)(299-303)(300-304)(300-422)(301-308)(301-422)(302-303)(304-310)(305-311)(305-423)(306-377)(306-383)(307-314)(307-423)(308-310)(309-317)(309-424)(311-313)(312-377)(312-389)(313-314)(315-318)(315-424)(316-323)(316-425)(317-325)(318-325)(319-324)(319-425)(320-378)(320-390)(321-327)(321-426)(322-329)(322-426)(323-326)(324-326)(327-330)(328-378)(328-384)(329-330)(331-337)(331-403)(332-336)(332-391)(333-334)(333-337)(334-335)(335-336)(338-339)(338-393)(339-340)(340-348)(341-343)(341-395)(342-345)(342-398)(343-344)(344-353)(345-361)(346-347)(346-404)(347-349)(348-349)(350-351)(350-352)(351-405)(352-353)(354-356)(354-360)(355-356)(355-406)(357-358)(357-359)(358-362)(359-407)(360-361)(362-367)(363-366)(363-368)(364-365)(364-366)(365-408)(367-369)(368-372)(369-370)(370-400)(371-372)(371-401)(373-392)(374-394)(375-396)(376-397)(377-399)(378-402)(379-427)(380-428)(381-429)(382-430)(383-431)(384-432)(385-386)(385-427)(386-428)(387-388)(387-429)(388-430)(389-390)(389-431)(390-432)(391-433)(392-433)(393-434)(394-434)(395-435)(396-435)(397-436)(398-436)(399-437)(400-437)(401-438)(402-438)(403-439)(404-440)(405-441)(406-442)(407-443)(408-444)(409-439)(410-439)(411-439)(412-440)(413-440)(414-440)(415-441)(416-441)(417-441)(418-442)(419-442)(420-442)(421-443)(422-443)(423-443)(424-444)(425-444)(426-444)(427-445)(428-445)(429-445)(430-445)(431-445)(432-445)

Measurements (9)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A3751.5— 10.1002/anie.202504970 2025
A549cisR1.6— 10.1002/anie.202504970 2025
HeLa2.1— 10.1002/anie.202504970 2025
A5492.1— 10.1002/anie.202504970 2025
MDA-MB-2312.4— 10.1002/anie.202504970 2025
SW6202.6— 10.1002/anie.202504970 2025
HLF3.9— 10.1002/anie.202504970 2025
SGC-79014.7— 10.1002/anie.202504970 2025
SGC-7901/DDP5.7— 10.1002/anie.202504970 2025

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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