[4-iodanyl-2,6-di(propan-2-yl)phenyl]azaniumylidynemolybdenum; molybdenum; heptadecahydrate

Systemtic Name: [4-iodanyl-2,6-di(propan-2-yl)phenyl]azaniumylidynemolybdenum; molybdenum; heptadecahydrate Openeye Name: (4-iodo-2,6-diisopropyl-phenyl)nitriliomolybdenum; molybdenum; heptadecahydrate CAS Name: [4-iodo-2,6-di(propan-2-yl)phenyl]nitriliomolybdenum; molybdenum; heptadecahydrate IUPAC Name: [4-iodo-2,6-di(propan-2-yl)phenyl]azaniumylidynemolybdenum; molybdenum; heptadecahydrate Traditional Name: (4-iodo-2,6-diisopropyl-phenyl)nitriliomolybdenum; molybdenum; heptadecahydrate Formula: C24H66I2Mo6N2O17+2 MolecularWeight: 1484.23298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C12H16IN.6Mo.17H2O/c2*1-7(2)10-5-9(13)6-11(8(3)4)12(10)14;;;;;;;;;;;;;;;;;;;;;;;/h2*5-8H,1-4H3;;;;;;;17*1H2/q2*+1;;;;;;;;;;;;;;;;;;;;;;;