bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium

C207H271Cl10N10P3Ru5-2 — CID 162023549

About bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium

bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium (PubChem CID 162023549) has the molecular formula C207H271Cl10N10P3Ru5-2 and a molecular weight of 3852.32 g/mol. Its IUPAC name is bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium.

Molecular Properties

• Compound Name: bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium
• PubChem CID: 162023549
• Molecular Formula: C207H271Cl10N10P3Ru5-2
• Molecular Weight: 3852.32 g/mol
• Exact Mass: 3849.28
• IUPAC Name: bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium
• SMILES: C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.CC(C)=CC=[Ru](Cl)Cl.CC(C)c1cccc(C(C)C)c1N1[CH-]C(C)(C)CC1(C)C.CC(C)c1cccc(C(C)C)c1N1[CH-]N(c2c(C(C)C)cccc2C(C)C)CC1.CCCCC=C=[Ru](Cl)Cl.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cl[Ru](Cl)=CCCc1ccccn1.Cl[Ru](Cl)=Cc1ccccc1.Cl[Ru](Cl)=Cc1ccccc1.c1ccc([PH+](c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)ccc1cccc(N3[CH-]N(c4cccc5ccc6ccccc6c45)CC3)c12
• InChI: InChI=1S/C31H23N2.C27H39N2.2C21H27N2.C20H32N.2C18H33P.C18H15P.C8H9N.2C7H6.C6H10.C5H8.10ClH.5Ru/c1-3-11-26-22(7-1)15-17-24-9-5-13-28(30(24)26)32-19-20-33(21-32)29-14-6-10-25-18-16-23-8-2-4-12-27(23)31(25)29;1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;2*1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-14(2)16-10-9-11-17(15(3)4)18(16)21-13-19(5,6)12-20(21,7)8;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-5-8-6-3-4-7-9-8;2*1-7-5-3-2-4-6-7;1-3-5-6-4-2;1-4-5(2)3;;;;;;;;;;;;;;;/h1-18,21H,19-20H2;9-14,17-21H,15-16H2,1-8H3;2*9-13H,7-8H2,1-6H3;9-11,13-15H,12H2,1-8H3;2*16-18H,1-15H2;1-15H;1,3-4,6-7H,2,5H2;2*1-6H;4H,3,5-6H2,1H3;1,4H,2-3H3;10*1H;;;;;/q5*-1;;;;;;;;;;;;;;;;;;;5*+2/p-7
• InChIKey: HPWGQZBHFGTSGS-UHFFFAOYSA-G
• XLogP: 61.03
• TPSA: 42.05 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 33
• Heavy Atoms: 235
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3852.32
LogP ≤ 5	61.03
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium?

The IUPAC name of bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium (CID 162023549) is bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium.

What is the SMILES notation for bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium?

The canonical SMILES for bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium is C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.CC(C)=CC=[Ru](Cl)Cl.CC(C)c1cccc(C(C)C)c1N1[CH-]C(C)(C)CC1(C)C.CC(C)c1cccc(C(C)C)c1N1[CH-]N(c2c(C(C)C)cccc2C(C)C)CC1.CCCCC=C=[Ru](Cl)Cl.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cl[Ru](Cl)=CCCc1ccccn1.Cl[Ru](Cl)=Cc1ccccc1.Cl[Ru](Cl)=Cc1ccccc1.c1ccc([PH+](c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)ccc1cccc(N3[CH-]N(c4cccc5ccc6ccccc6c45)CC3)c12.

What is the InChIKey of bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium?

The InChIKey is HPWGQZBHFGTSGS-UHFFFAOYSA-G. The full InChI is InChI=1S/C31H23N2.C27H39N2.2C21H27N2.C20H32N.2C18H33P.C18H15P.C8H9N.2C7H6.C6H10.C5H8.10ClH.5Ru/c1-3-11-26-22(7-1)15-17-24-9-5-13-28(30(24)26)32-19-20-33(21-32)29-14-6-10-25-18-16-23-8-2-4-12-27(23)31(25)29;1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;2*1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-14(2)16-10-9-11-17(15(3)4)18(16)21-13-19(5,6)12-20(21,7)8;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-5-8-6-3-4-7-9-8;2*1-7-5-3-2-4-6-7;1-3-5-6-4-2;1-4-5(2)3;;;;;;;;;;;;;;;/h1-18,21H,19-20H2;9-14,17-21H,15-16H2,1-8H3;2*9-13H,7-8H2,1-6H3;9-11,13-15H,12H2,1-8H3;2*16-18H,1-15H2;1-15H;1,3-4,6-7H,2,5H2;2*1-6H;4H,3,5-6H2,1H3;1,4H,2-3H3;10*1H;;;;;/q5*-1;;;;;;;;;;;;;;;;;;;5*+2/p-7.

What are the key properties of bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium?

bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium has a molecular weight of 3852.32 g/mol, XLogP of 61.03, 33 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for bis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(hex-1-enylidene)ruthenium;dichloro(3-methylbut-2-enylidene)ruthenium;dichloro(3-pyridin-2-ylpropylidene)ruthenium;1,3-di(phenanthren-4-yl)imidazolidin-2-ide;1-[2,6-di(propan-2-yl)phenyl]-2,2,4,4-tetramethylpyrrolidin-5-ide;bis(tricyclohexylphosphanium);triphenylphosphanium is sourced from PubChem (CID 162023549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).