cobalt(2+); ethyl(dimethyl)sulfanium; 1-oxidanylhexyl(propyl)sulfanium; hexanitrite

Systemtic Name: cobalt(2+); ethyl(dimethyl)sulfanium; 1-oxidanylhexyl(propyl)sulfanium; hexanitrite Openeye Name: cobaltous; ethyl(dimethyl)sulfonium; 1-hydroxyhexyl(propyl)sulfonium; hexanitrite CAS Name: cobalt(2+); ethyl(dimethyl)sulfonium; 1-hydroxyhexyl(propyl)sulfonium; hexanitrite IUPAC Name: cobalt(2+); ethyl(dimethyl)sulfanium; 1-hydroxyhexyl(propyl)sulfanium; hexanitrite Traditional Name: cobaltous; ethyl(dimethyl)sulfonium; 1-hydroxyhexyl(propyl)sulfonium; hexanitrite Formula: C26H64CoN6O14S4 MolecularWeight: 872.01136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(O)[SH+]CCC.CCCCCC(O)[SH+]CCC.CC[S+](C)C.CC[S+](C)C.N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[Co+2]

Isomeric SMILES

CCCCCC(O)[SH+]CCC.CCCCCC(O)[SH+]CCC.CC[S+](C)C.CC[S+](C)C.N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[Co+2]

InChI

InChI=1S/2C9H20OS.2C4H11S.Co.6HNO2/c2*1-3-5-6-7-9(10)11-8-4-2;2*1-4-5(2)3;;6*2-1-3/h2*9-10H,3-8H2,1-2H3;2*4H2,1-3H3;;6*(H,2,3)/q;;2*+1;+2;;;;;;/p-4