carbon monoxide; cobalt; diphenylphosphanylmethyl(diphenyl)phosphane; hexadeca-2,4,6,8,10,12,14-heptayne

Systemtic Name: carbon monoxide; cobalt; diphenylphosphanylmethyl(diphenyl)phosphane; hexadeca-2,4,6,8,10,12,14-heptayne Openeye Name: carbon monoxide; cobalt; diphenylphosphanylmethyl(diphenyl)phosphane; hexadeca-2,4,6,8,10,12,14-heptayne CAS Name: carbon monoxide; cobalt; diphenylphosphinomethyl(diphenyl)phosphine; hexadeca-2,4,6,8,10,12,14-heptayne IUPAC Name: carbon monoxide; cobalt; diphenylphosphanylmethyl(diphenyl)phosphane; hexadeca-2,4,6,8,10,12,14-heptayne Traditional Name: carbon monoxide; cobalt; diphenylphosphinomethyl(diphenyl)phosphine; hexadeca-2,4,6,8,10,12,14-heptayne Formula: C80H48Co6O14P4-2 MolecularWeight: 1710.722964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C#CC#CC#CC#CC#CC#CC#C[CH2-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Co].[Co].[Co].[Co].[Co].[Co]

Isomeric SMILES

[CH2-]C#CC#CC#CC#CC#CC#CC#C[CH2-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Co].[Co].[Co].[Co].[Co].[Co]

InChI

InChI=1S/2C25H22P2.C16H4.14CO.6Co/c2*1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2;14*1-2;;;;;;/h2*1-20H,21H2;1-2H2;;;;;;;;;;;;;;;;;;;;/q;;-2;;;;;;;;;;;;;;;;;;;;