cobalt; 1,1-dimethyl-3-[(E)-pyrazin-2-ylmethylideneamino]thiourea; tetrafluoroborate

Systemtic Name: cobalt; 1,1-dimethyl-3-[(E)-pyrazin-2-ylmethylideneamino]thiourea; tetrafluoroborate Openeye Name: cobalt; 1,1-dimethyl-3-[(E)-pyrazin-2-ylmethyleneamino]thiourea; tetrafluoroborate CAS Name: cobalt; 1,1-dimethyl-3-[(E)-2-pyrazinylmethylideneamino]thiourea; tetrafluoroborate IUPAC Name: cobalt; 1,1-dimethyl-3-[(E)-pyrazin-2-ylmethylideneamino]thiourea; tetrafluoroborate Traditional Name: cobalt; 1,1-dimethyl-3-[(E)-pyrazin-2-ylmethyleneamino]thiourea; tetrafluoroborate Formula: C16H22BCoF4N10S2- MolecularWeight: 564.280693

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CN(C)C(=S)NN=CC1=NC=CN=C1.CN(C)C(=S)NN=CC1=NC=CN=C1.[Co]

Isomeric SMILES

[B-](F)(F)(F)F.CN(C(=S)N/N=C/C1=NC=CN=C1)C.CN(C(=S)N/N=C/C1=NC=CN=C1)C.[Co]

InChI

InChI=1S/2C8H11N5S.BF4.Co/c2*1-13(2)8(14)12-11-6-7-5-9-3-4-10-7;2-1(3,4)5;/h2*3-6H,1-2H3,(H,12,14);;/q;;-1;/b2*11-6+;;