ZQ2
[Ru2(N,N'-bis(4-fluorophenyl)formamidinate)(1,1-ethanediol)
Created: | 2023-06-29 |
Last modified: | 2023-09-13 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 37 |
Chiral Atom Count | 0 |
Bond Count | 40 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | [Ru2(N,N'-bis(4-fluorophenyl)formamidinate)(1,1-ethanediol) |
Synonyms | 3-methyl-6,8-diphenyl-2,4-dioxa-6,8-diaza-1$l^{3},5$l^{3}-diruthenabicyclo[3.3.0]octane |
Systematic Name (OpenEye OEToolkits) | 3-methyl-6,8-diphenyl-2,4-dioxa-6,8-diaza-1$l^{3},5$l^{3}-diruthenabicyclo[3.3.0]octane |
Formula | C15 H16 N2 O2 Ru2 |
Molecular Weight | 458.44 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CC1O[Ru]N(CN([Ru]O1)c2ccccc2)c3ccccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1O[Ru]2N(CN([Ru]2O1)c3ccccc3)c4ccccc4 |
Canonical SMILES | CACTVS | 3.385 | CC1O[Ru]N(CN([Ru]O1)c2ccccc2)c3ccccc3 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CC1O[Ru]2N(CN([Ru]2O1)c3ccccc3)c4ccccc4 |
InChI | InChI | 1.06 | InChI=1S/C13H12N2.C2H4O2.2Ru/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;1-2(3)4;;/h1-10H,11H2;2H,1H3;;/q2*-2;2*+2 |
InChIKey | InChI | 1.06 | HYYYEFNDCLICTP-UHFFFAOYSA-N |