chloranylrhenium; 2-isocyano-2-methyl-propane; tricyclohexylphosphane

Systemtic Name: chloranylrhenium; 2-isocyano-2-methyl-propane; tricyclohexylphosphane Openeye Name: chlororhenium; 2-isocyano-2-methyl-propane; tricyclohexylphosphane CAS Name: chlororhenium; 2-isocyano-2-methylpropane; tricyclohexylphosphine IUPAC Name: chlororhenium; 2-isocyano-2-methylpropane; tricyclohexylphosphane Traditional Name: chlororhenium; 2-isocyano-2-methyl-propane; tricyclohexylphosphine Formula: C51H93ClN3P2Re MolecularWeight: 1031.911742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.Cl[Re]

Isomeric SMILES

CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].CC(C)(C)[N+]#[C-].C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.Cl[Re]

InChI

InChI=1S/2C18H33P.3C5H9N.ClH.Re/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-5(2,3)6-4;;/h2*16-18H,1-15H2;3*1-3H3;1H;/q;;;;;;+1/p-1