carbon monoxide; cyclopenta-1,3-diene; molybdenum; 3-phenylcyclopent-3-ene-1,1,2,2-tetracarbonitrile

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; molybdenum; 3-phenylcyclopent-3-ene-1,1,2,2-tetracarbonitrile Openeye Name: carbon monoxide; cyclopenta-1,3-diene; molybdenum; 3-phenylcyclopent-3-ene-1,1,2,2-tetracarbonitrile CAS Name: carbon monoxide; cyclopenta-1,3-diene; molybdenum; 3-phenylcyclopent-3-ene-1,1,2,2-tetracarbonitrile IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; molybdenum; 3-phenylcyclopent-3-ene-1,1,2,2-tetracarbonitrile Traditional Name: carbon monoxide; cyclopenta-1,3-diene; molybdenum; 3-phenylcyclopent-3-ene-1,1,2,2-tetracarbonitrile Formula: C23H12MoN4O3-2 MolecularWeight: 488.30638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1[C-]=C(C(C1(C#N)C#N)(C#N)C#N)C2=CC=CC=C2.[CH-]1C=CC=C1.[Mo]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1[C-]=C(C(C1(C#N)C#N)(C#N)C#N)C2=CC=CC=C2.[CH-]1C=CC=C1.[Mo]

InChI

InChI=1S/C15H7N4.C5H5.3CO.Mo/c16-8-14(9-17)7-6-13(15(14,10-18)11-19)12-4-2-1-3-5-12;1-2-4-5-3-1;3*1-2;/h1-5H,7H2;1-5H;;;;/q2*-1;;;;