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Cyclopentadienyldicyanomethylenediphenylcobaltadithiolene complex
SpectraBase Compound ID CSkIHV2Gj18
InChI InChI=1S/C14H12S2.C5H5.C3N2.Co/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2-4-5-3-1;4-2-1-3-5;/h1-10,15-16H;1-5H;;/q;;;+2/p-2/b14-13-;;;
InChIKey FDKWVQBAXQLKCL-JRYLAINFSA-L
Mol Weight 430.43 g/mol
Molecular Formula C22H15CoN2S2
Exact Mass 430.00086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XGAdBHxHBl
Name Cyclopentadienyldicyanomethylenediphenylcobaltadithiolene complex
Comments Less than 3 mono-isotopic peaks
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Formula C22H15CoN2S2
InChI InChI=1S/C14H12S2.C5H5.C3N2.Co/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-2-4-5-3-1;4-2-1-3-5;/h1-10,15-16H;1-5H;;/q;;;+2/p-2/b14-13-;;;
InChIKey FDKWVQBAXQLKCL-JRYLAINFSA-L
Molecular Weight 430.429 g/mol
SMILES [C@]12([Co]3456([C@]2([C@@]6([C@@]4([C@]13[H])[H])[H])[H])(SC(c1ccccc1)=C(S5)c1ccccc1)=C(C#N)C#N)[H]
SPLASH splash10-014i-0009100000-60000736822419e38971
Source of Spectrum C4-1998-242-2
Wiley ID 1519929