(Z)-3-cyclopentyl-2-phenyl-but-2-en-1-one; ruthenium(2+); triphenylphosphane

Systemtic Name: (Z)-3-cyclopentyl-2-phenyl-but-2-en-1-one; ruthenium(2+); triphenylphosphane Openeye Name: (Z)-3-cyclopentyl-2-phenyl-but-2-en-1-one; ruthenium(2+); triphenylphosphane CAS Name: (Z)-3-cyclopentyl-2-phenyl-2-buten-1-one; ruthenium(2+); triphenylphosphine IUPAC Name: (Z)-3-cyclopentyl-2-phenylbut-2-en-1-one; ruthenium(2+); triphenylphosphane Traditional Name: (Z)-3-cyclopentyl-2-phenyl-but-2-en-1-one; ruthenium(2+); triphenylphosphine Formula: C51H47OP2Ru+ MolecularWeight: 838.935802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C([C-]=O)C1=CC=CC=C1)C2CCCC2.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.[Ru+2]

Isomeric SMILES

C/C(=C(/[C-]=O)\C1=CC=CC=C1)/C2CCCC2.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.[Ru+2]

InChI

InChI=1S/2C18H15P.C15H17O.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-12(13-7-5-6-8-13)15(11-16)14-9-3-2-4-10-14;/h2*1-15H;2-4,9-10,13H,5-8H2,1H3;/q;;-1;+2/b;;15-12+;