carbon monoxide; cyclopentane; 2-phenylbut-3-yn-2-ylbenzene; ruthenium(2+); tri(propan-2-yl)phosphane

Systemtic Name: carbon monoxide; cyclopentane; 2-phenylbut-3-yn-2-ylbenzene; ruthenium(2+); tri(propan-2-yl)phosphane Openeye Name: carbon monoxide; cyclopentane; (1-methyl-1-phenyl-prop-2-ynyl)benzene; ruthenium(2+); triisopropylphosphane CAS Name: carbon monoxide; cyclopentane; 2-phenylbut-3-yn-2-ylbenzene; ruthenium(2+); tri(propan-2-yl)phosphine IUPAC Name: carbon monoxide; cyclopentane; 2-phenylbut-3-yn-2-ylbenzene; ruthenium(2+); tri(propan-2-yl)phosphane Traditional Name: carbon monoxide; cyclopentane; (1-methyl-1-phenyl-prop-2-ynyl)benzene; ruthenium(2+); triisopropylphosphine Formula: C31H39OPRu+ MolecularWeight: 559.684521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13.C9H21P.C5H5.CO.Ru/c1-3-16(2,14-10-6-4-7-11-14)15-12-8-5-9-13-15;1-7(2)10(8(3)4)9(5)6;1-2-4-5-3-1;1-2;/h4-13H,2H3;7-9H,1-6H3;1-5H;;/q-1;;;;+2