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8WV

Summary
Name:dichloro[(1,2,3,4,5,6-eta)-3-methyl-6-(propan-2-yl)benzene-1,2,4,5-tetrayl]osmium
Formula:C10 H10 Cl2 Os
Formal charge:0
Formula weight:391.322 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01dichloro[(1,2,3,4,5,6-eta)-3-methyl-6-(propan-2-yl)benzene-1,2,4,5-tetrayl]osmium

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CC(C6=5C=1[Os]4326(Cl)(C=1C2(C)=C3C4=5)Cl)C
InChIInChI1.03InChI=1S/C10H10.2ClH.Os/c1-8(2)10-6-4-9(3)5-7-10;;;/h8H,1-3H3;2*1H;/q;;;+2/p-2
InChIKeyInChI1.03WKSPPTHHDBHBPQ-UHFFFAOYSA-L
SMILES_CANONICALCACTVS3.385CC(C)C1=CC=C(C)C=C1.Cl[Os]Cl
SMILESCACTVS3.385CC(C)C1=CC=C(C)C=C1.Cl[Os]Cl
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(C)C12=C3[Os]1456(C2=C4C5(=C63)C)(Cl)Cl
SMILESOpenEye OEToolkits2.0.6CC(C)C12=C3[Os]1456(C2=C4C5(=C63)C)(Cl)Cl

223532

PDB entries from 2024-08-07

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