(4-iodanyl-2,6-dimethyl-phenyl)azaniumylidynemolybdenum; tungsten; octadecahydrate

Systemtic Name: (4-iodanyl-2,6-dimethyl-phenyl)azaniumylidynemolybdenum; tungsten; octadecahydrate Openeye Name: (4-iodo-2,6-dimethyl-phenyl)nitriliomolybdenum; tungsten; octadecahydrate CAS Name: (4-iodo-2,6-dimethylphenyl)nitriliomolybdenum; tungsten; octadecahydrate IUPAC Name: (4-iodo-2,6-dimethylphenyl)azaniumylidynemolybdenum; tungsten; octadecahydrate Traditional Name: (4-iodo-2,6-dimethyl-phenyl)nitriliomolybdenum; tungsten; octadecahydrate Formula: C8H44IMoNO18W5+ MolecularWeight: 1584.47533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+]#[Mo])C)I.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[W].[W].[W].[W].[W]

Isomeric SMILES

CC1=CC(=CC(=C1[N+]#[Mo])C)I.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[W].[W].[W].[W].[W]

InChI

InChI=1S/C8H8IN.Mo.18H2O.5W/c1-5-3-7(9)4-6(2)8(5)10;;;;;;;;;;;;;;;;;;;;;;;;/h3-4H,1-2H3;;18*1H2;;;;;/q+1;;;;;;;;;;;;;;;;;;;;;;;;