2-[(3E)-1,4-diphenylbuta-1,3-dienyl]-3-phenyl-buta-1,3-diene-1,1,4,4-tetracarbonitrile; 1,2,3,4,5-pentamethylcyclopentane; ruthenium(2+); triphenylphosphane

Systemtic Name: 2-[(3E)-1,4-diphenylbuta-1,3-dienyl]-3-phenyl-buta-1,3-diene-1,1,4,4-tetracarbonitrile; 1,2,3,4,5-pentamethylcyclopentane; ruthenium(2+); triphenylphosphane Openeye Name: 2-[(3E)-1,4-diphenylbuta-1,3-dienyl]-3-phenyl-buta-1,3-diene-1,1,4,4-tetracarbonitrile; 1,2,3,4,5-pentamethylcyclopentane; ruthenium(2+); triphenylphosphane CAS Name: 2-[(3E)-1,4-diphenylbuta-1,3-dienyl]-3-phenylbuta-1,3-diene-1,1,4,4-tetracarbonitrile; 1,2,3,4,5-pentamethylcyclopentane; ruthenium(2+); triphenylphosphine IUPAC Name: 2-[(3E)-1,4-diphenylbuta-1,3-dienyl]-3-phenylbuta-1,3-diene-1,1,4,4-tetracarbonitrile; 1,2,3,4,5-pentamethylcyclopentane; ruthenium(2+); triphenylphosphane Traditional Name: 2-[(3E)-1,4-diphenylbuta-1,3-dienyl]-3-phenyl-buta-1,3-diene-1,1,4,4-tetracarbonitrile; 1,2,3,4,5-pentamethylcyclopentane; ruthenium(2+); triphenylphosphine Formula: C58H47N4PRu+ MolecularWeight: 932.064341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[C]1[C]([C]([C]([C]1C)C)C)C.C1=CC=C(C=C1)C=C[C-]=C(C2=CC=CC=C2)C(=C(C#N)C#N)C(=C(C#N)C#N)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ru+2]

Isomeric SMILES

C[C]1[C]([C]([C]([C]1C)C)C)C.C1=CC=C(C=C1)/C=C/[C-]=C(C2=CC=CC=C2)C(=C(C#N)C#N)C(=C(C#N)C#N)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ru+2]

InChI

InChI=1S/C30H17N4.C18H15P.C10H15.Ru/c31-19-26(20-32)29(25-16-8-3-9-17-25)30(27(21-33)22-34)28(24-14-6-2-7-15-24)18-10-13-23-11-4-1-5-12-23;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-6-7(2)9(4)10(5)8(6)3;/h1-17H;1-15H;1-5H3;/q-1;;;+2/b13-10+;;;