Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

7GE

Summary
Name:pentakis(chloranyl)-(1~{H}-indazol-2-ium-2-yl)ruthenium(1-)
Formula:C7 H6 Cl5 N2 Ru
Formal charge:0
Formula weight:396.471 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6pentakis(chloranyl)-(1~{H}-indazol-2-ium-2-yl)ruthenium(1-)

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H6N2.5ClH.Ru/c1-2-4-7-6(3-1)5-8-9-7;;;;;;/h1-5H,(H,8,9);5*1H;/q;;;;;;+5/p-5
InChIKeyInChI1.03BDILZFSGPXXJCX-UHFFFAOYSA-I
SMILES_CANONICALCACTVS3.385Cl[Ru-](Cl)(Cl)(Cl)(Cl)[n+]1[nH]c2ccccc2c1
SMILESCACTVS3.385Cl[Ru-](Cl)(Cl)(Cl)(Cl)[n+]1[nH]c2ccccc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc2c(c1)c[n+]([nH]2)[Ru-](Cl)(Cl)(Cl)(Cl)Cl
SMILESOpenEye OEToolkits2.0.6c1ccc2c(c1)c[n+]([nH]2)[Ru-](Cl)(Cl)(Cl)(Cl)Cl

223166

PDB entries from 2024-07-31

PDB statisticsPDBj update infoContact PDBjnumon