chloranylruthenium; 1,2,3,4,5-pentamethylcyclopentane; triphenylphosphane

Systemtic Name: chloranylruthenium; 1,2,3,4,5-pentamethylcyclopentane; triphenylphosphane Openeye Name: chlororuthenium; 1,2,3,4,5-pentamethylcyclopentane; triphenylphosphane CAS Name: chlororuthenium; 1,2,3,4,5-pentamethylcyclopentane; triphenylphosphine IUPAC Name: chlororuthenium; 1,2,3,4,5-pentamethylcyclopentane; triphenylphosphane Traditional Name: chlororuthenium; 1,2,3,4,5-pentamethylcyclopentane; triphenylphosphine Formula: C46H45ClP2Ru MolecularWeight: 796.320022

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Descriptors Computed from Structure

Canonical SMILES:

C[C]1[C]([C]([C]([C]1C)C)C)C.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.Cl[Ru]

Isomeric SMILES

C[C]1[C]([C]([C]([C]1C)C)C)C.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.Cl[Ru]

InChI

InChI=1S/2C18H15P.C10H15.ClH.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-6-7(2)9(4)10(5)8(6)3;;/h2*1-15H;1-5H3;1H;/q;;;;+1/p-1