ZWO

Ru2(DPhF)(CO3)3

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

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Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count0
Bond Count46
Aromatic Bond Count12
2D diagram of ZWO

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Chemical Component Summary

NameRu2(DPhF)(CO3)3
FormulaC16 H12 N2 O9 Ru2
Molecular Weight578.414
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385O=C1O[Ru]23OC(=O)O[Ru](O1)(OC(=O)O2)N(CN3c4ccccc4)c5ccccc5
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)N2CN([Ru]345[Ru]2(OC(=O)O3)(OC(=O)O4)OC(=O)O5)c6ccccc6
Canonical SMILESCACTVS3.385 O=C1O[Ru]23OC(=O)O[Ru](O1)(OC(=O)O2)N(CN3c4ccccc4)c5ccccc5
Canonical SMILESOpenEye OEToolkits2.0.7 c1ccc(cc1)N2CN([Ru]345[Ru]2(OC(=O)O3)(OC(=O)O4)OC(=O)O5)c6ccccc6
InChIInChI1.06 InChI=1S/C13H12N2.3CH2O3.2Ru/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;3*2-1(3)4;;/h1-10H,11H2;3*(H2,2,3,4);;/q-2;;;;2*+4/p-6
InChIKeyInChI1.06 TZCHHEUOTVFLIC-UHFFFAOYSA-H