ZXE

Ru2(DPhF)(CO3)2(Formate)

Created:2023-07-07
Last modified:  2023-09-13

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Chemical Details

Formal Charge0
Atom Count42
Chiral Atom Count0
Bond Count47
Aromatic Bond Count12
2D diagram of ZXE

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Chemical Component Summary

NameRu2(DPhF)(CO3)2(Formate)
FormulaC16 H14 N2 O8 Ru2
Molecular Weight564.431
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385O=C1O[Ru]23OCO[Ru](O1)(OC(=O)O2)N(CN3c4ccccc4)c5ccccc5
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)N2CN([Ru]345[Ru]2(OCO3)(OC(=O)O4)OC(=O)O5)c6ccccc6
Canonical SMILESCACTVS3.385 O=C1O[Ru]23OCO[Ru](O1)(OC(=O)O2)N(CN3c4ccccc4)c5ccccc5
Canonical SMILESOpenEye OEToolkits2.0.7 c1ccc(cc1)N2CN([Ru]345[Ru]2(OCO3)(OC(=O)O4)OC(=O)O5)c6ccccc6
InChIInChI1.06 InChI=1S/C13H12N2.2CH2O3.CH2O2.2Ru/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;2*2-1(3)4;2-1-3;;/h1-10H,11H2;2*(H2,2,3,4);1H2;;/q-2;;;-2;2*+4/p-4
InChIKeyInChI1.06 VXNQBXDONZSVPB-UHFFFAOYSA-J