2-adamantyl-(3,5-dimethylphenyl)azanide; molybdenum(3+)

Systemtic Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; molybdenum(3+) Openeye Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; molybdenum(3+) CAS Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; molybdenum(3+) IUPAC Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; molybdenum(3+) Traditional Name: 2-adamantyl-(3,5-dimethylphenyl)azanide; molybdenum(3+) Formula: C54H72MoN3 MolecularWeight: 859.10958

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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.[Mo+3]

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.[Mo+3]

InChI

InChI=1S/3C18H24N.Mo/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;+3