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BioLiP

PDB CCD ID: RBN
Number of entries in BioLiP: 2
Chemical formula: C6 H6 Cl2 Ru
InChI: InChI=1S/C6H6.2ClH.Ru/c1-2-4-6-5-3-1;;;/h1-6H;2*1H;/q;;;+2/p-2
InChIKey: NDWWOISDNSYBCH-UHFFFAOYSA-L
SMILES:
SoftwareSMILES
ACDLabs 12.01Cl[Ru]65432(Cl)C=1C6=C5C4=C3C=12
OpenEye OEToolkits 1.7.6[CH]12=[CH]3[Ru]1456([CH]2=[CH]4[CH]5=[CH]63)(Cl)Cl
CACTVS 3.370Cl[Ru]|1|2|3|4|5(Cl)|C6=C|1C|2=C|3C|4=C|56
Name:Benzeneruthenium(II) chloride
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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