calcium dimethylaminomethylideneoxidanium dithiocyanate

Systemtic Name: calcium dimethylaminomethylideneoxidanium dithiocyanate Openeye Name: calcium dimethylaminomethyleneoxonium dithiocyanate CAS Name: calcium dimethylaminomethylideneoxonium dithiocyanate IUPAC Name: calcium dimethylaminomethylideneoxidanium dithiocyanate Traditional Name: calcium dimethylaminomethyleneoxonium dithiocyanate Formula: C14H32CaN6O4S2+4 MolecularWeight: 452.64968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=[OH+].CN(C)C=[OH+].CN(C)C=[OH+].CN(C)C=[OH+].C(#N)[S-].C(#N)[S-].[Ca+2]

Isomeric SMILES

CN(C)C=[OH+].CN(C)C=[OH+].CN(C)C=[OH+].CN(C)C=[OH+].C(#N)[S-].C(#N)[S-].[Ca+2]

InChI

InChI=1S/4C3H7NO.2CHNS.Ca/c4*1-4(2)3-5;2*2-1-3;/h4*3H,1-2H3;2*3H;/q;;;;;;+2/p+2