carbon monoxide; oxoazane; rhenium; triphenylphosphane; tris(fluoranyl)methanesulfonate

Systemtic Name: carbon monoxide; oxoazane; rhenium; triphenylphosphane; tris(fluoranyl)methanesulfonate Openeye Name: carbon monoxide; nitroxyl; rhenium; trifluoromethanesulfonate; triphenylphosphane CAS Name: carbon monoxide; nitrosyl hydride; rhenium; trifluoromethanesulfonate; triphenylphosphine IUPAC Name: carbon monoxide; nitroxyl; rhenium; trifluoromethanesulfonate; triphenylphosphane Traditional Name: carbon monoxide; nitrosyl hydride; rhenium; triphenylphosphine; triflate Formula: C40H31F3NO7P2ReS- MolecularWeight: 974.891372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[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(F)(F)(F)S(=O)(=O)[O-].N=O.[Re]

Isomeric SMILES

[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(F)(F)(F)S(=O)(=O)[O-].N=O.[Re]

InChI

InChI=1S/2C18H15P.CHF3O3S.3CO.HNO.Re/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(3,4)8(5,6)7;4*1-2;/h2*1-15H;(H,5,6,7);;;;1H;/p-1