[(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)

C60H60Cl2N2O4P2Ru+2 — CID 163196562

About [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)

[(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+) (PubChem CID 163196562) has the molecular formula C60H60Cl2N2O4P2Ru+2 and a molecular weight of 1107.07 g/mol. Its IUPAC name is [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+).

Molecular Properties

• Compound Name: [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)
• PubChem CID: 163196562
• Molecular Formula: C60H60Cl2N2O4P2Ru+2
• Molecular Weight: 1107.07 g/mol
• Exact Mass: 1106.24
• IUPAC Name: [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)
• SMILES: Cc1cc(C)cc([PH+](c2cc(C)cc(C)c2)c2ccc3c(c2-c2c([PH+](c4cc(C)cc(C)c4)c4cc(C)cc(C)c4)ccc4c2OCO4)OCO3)c1.Cl[Ru+2]Cl.[NH-][C@H](c1ccccc1)[C@H]([NH-])c1ccccc1
• InChI: InChI=1S/C46H44O4P2.C14H14N2.2ClH.Ru/c1-27-13-28(2)18-35(17-27)51(36-19-29(3)14-30(4)20-36)41-11-9-39-45(49-25-47-39)43(41)44-42(12-10-40-46(44)50-26-48-40)52(37-21-31(5)15-32(6)22-37)38-23-33(7)16-34(8)24-38;15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;;;/h9-24H,25-26H2,1-8H3;1-10,13-16H;2*1H;/q;-2;;;+4/t;13-,14-;;;/m.1.../s1
• InChIKey: GTERHDJUXJSCSP-ODQAEMFESA-N
• XLogP: 14.21
• TPSA: 84.52 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1107.07
LogP ≤ 5	14.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)?

The IUPAC name of [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+) (CID 163196562) is [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+).

What is the SMILES notation for [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)?

The canonical SMILES for [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+) is Cc1cc(C)cc([PH+](c2cc(C)cc(C)c2)c2ccc3c(c2-c2c([PH+](c4cc(C)cc(C)c4)c4cc(C)cc(C)c4)ccc4c2OCO4)OCO3)c1.Cl[Ru+2]Cl.[NH-][C@H](c1ccccc1)[C@H]([NH-])c1ccccc1.

What is the InChIKey of [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)?

The InChIKey is GTERHDJUXJSCSP-ODQAEMFESA-N. The full InChI is InChI=1S/C46H44O4P2.C14H14N2.2ClH.Ru/c1-27-13-28(2)18-35(17-27)51(36-19-29(3)14-30(4)20-36)41-11-9-39-45(49-25-47-39)43(41)44-42(12-10-40-46(44)50-26-48-40)52(37-21-31(5)15-32(6)22-37)38-23-33(7)16-34(8)24-38;15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;;;/h9-24H,25-26H2,1-8H3;1-10,13-16H;2*1H;/q;-2;;;+4/t;13-,14-;;;/m.1.../s1.

What are the key properties of [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+)?

[(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+) has a molecular weight of 1107.07 g/mol, XLogP of 14.21, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [(1R,2R)-2-azanidyl-1,2-diphenylethyl]azanide;[4-[5-bis(3,5-dimethylphenyl)phosphaniumyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphanium;dichlororuthenium(2+) is sourced from PubChem (CID 163196562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).