diphenyl(pyridin-2-yl)phosphane; (Z)-4-oxidanylpent-3-en-2-one; ruthenium

Systemtic Name: diphenyl(pyridin-2-yl)phosphane; (Z)-4-oxidanylpent-3-en-2-one; ruthenium Openeye Name: diphenyl(2-pyridyl)phosphane; (Z)-4-hydroxypent-3-en-2-one; ruthenium CAS Name: diphenyl(2-pyridinyl)phosphine; (Z)-4-hydroxy-3-penten-2-one; ruthenium IUPAC Name: diphenyl(pyridin-2-yl)phosphane; (Z)-4-hydroxypent-3-en-2-one; ruthenium Traditional Name: diphenyl(2-pyridyl)phosphine; (Z)-4-hydroxypent-3-en-2-one; ruthenium Formula: C44H44N2O4P2Ru MolecularWeight: 827.848682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.CC(=CC(=O)C)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=N3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=N3.[Ru]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C1=CC=C(C=C1)P(C2=CC=CC=N2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=N2)C3=CC=CC=C3.[Ru]

InChI

InChI=1S/2C17H14NP.2C5H8O2.Ru/c2*1-3-9-15(10-4-1)19(16-11-5-2-6-12-16)17-13-7-8-14-18-17;2*1-4(6)3-5(2)7;/h2*1-14H;2*3,6H,1-2H3;/b;;2*4-3-;