[4-[2-(3,5-ditert-butylphenyl)ethynyl]-2,6-dimethyl-phenyl]azaniumylidynemolybdenum

Systemtic Name: [4-[2-(3,5-ditert-butylphenyl)ethynyl]-2,6-dimethyl-phenyl]azaniumylidynemolybdenum Openeye Name: [4-[2-(3,5-ditert-butylphenyl)ethynyl]-2,6-dimethyl-phenyl]nitriliomolybdenum CAS Name: [4-[2-(3,5-ditert-butylphenyl)ethynyl]-2,6-dimethylphenyl]nitriliomolybdenum IUPAC Name: [4-[2-(3,5-ditert-butylphenyl)ethynyl]-2,6-dimethylphenyl]azaniumylidynemolybdenum Traditional Name: [4-[2-(3,5-ditert-butylphenyl)ethynyl]-2,6-dimethyl-phenyl]nitriliomolybdenum Formula: C24H29MoN+ MolecularWeight: 427.43376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+]#[Mo])C)C#CC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1[N+]#[Mo])C)C#CC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C24H29N.Mo/c1-16-11-18(12-17(2)22(16)25)9-10-19-13-20(23(3,4)5)15-21(14-19)24(6,7)8;/h11-15H,1-8H3;/q+1;