2-adamantyl-(3,5-dimethylphenyl)azanide; phosphanylidynemolybdenum

Systemtic Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; phosphanylidynemolybdenum Openeye Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; phosphanylidynemolybdenum CAS Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; phosphinidynemolybdenum IUPAC Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; phosphanylidynemolybdenum Traditional Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; phosphinidynemolybdenum Formula: C54H72MoN3P-3 MolecularWeight: 890.083341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)[N-]C2C3CC4CC(C3)CC2C4)C.CC1=CC(=CC(=C1)[N-]C2C3CC4CC(C3)CC2C4)C.CC1=CC(=CC(=C1)[N-]C2C3CC4CC(C3)CC2C4)C.P#[Mo]

Isomeric SMILES

CC1=CC(=CC(=C1)[N-]C2C3CC4CC(C3)CC2C4)C.CC1=CC(=CC(=C1)[N-]C2C3CC4CC(C3)CC2C4)C.CC1=CC(=CC(=C1)[N-]C2C3CC4CC(C3)CC2C4)C.P#[Mo]

InChI

InChI=1S/3C18H24N.Mo.P/c3*1-11-3-12(2)5-17(4-11)19-18-15-7-13-6-14(9-15)10-16(18)8-13;;/h3*3-5,13-16,18H,6-10H2,1-2H3;;/q3*-1;;