azanylidynetungsten(1+); carbon monoxide; triphenylphosphane; isocyanate

Systemtic Name: azanylidynetungsten(1+); carbon monoxide; triphenylphosphane; isocyanate Openeye Name: carbon monoxide; nitridotungsten(1+); triphenylphosphane; isocyanate CAS Name: carbon monoxide; nitrilotungsten(1+); triphenylphosphine; isocyanate IUPAC Name: azanylidynetungsten(1+); carbon monoxide; triphenylphosphane; isocyanate Traditional Name: carbon monoxide; nitrilotungsten(1+); triphenylphosphine; isocyanate Formula: C42H30N2O6P2W MolecularWeight: 904.484922

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(=[N-])=O.N#[W+]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(=[N-])=O.N#[W+]

InChI

InChI=1S/2C18H15P.CNO.5CO.N.W/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2-1-3;5*1-2;;/h2*1-15H;;;;;;;;/q;;-1;;;;;;;+1