Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)

C₂₀H₃₀Cl₄Rh₂ — CID 71310421

About Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)

Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene) (PubChem CID 71310421) has the molecular formula C₂₀H₃₀Cl₄Rh₂ and a molecular weight of 618.08 g/mol. Its IUPAC name is bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene).

Molecular Properties

• Compound Name: Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)
• PubChem CID: 71310421
• Molecular Formula: C₂₀H₃₀Cl₄Rh₂
• Molecular Weight: 618.08 g/mol
• Exact Mass: 615.92
• IUPAC Name: bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)
• SMILES: Cc1c(C)c(C)[c-](C)c1C.Cc1c(C)c(C)[c-](C)c1C.Cl[Rh+]Cl.Cl[Rh+]Cl
• InChI: InChI=1S/2C10H15.4ClH.2Rh/c2*1-6-7(2)9(4)10(5)8(6)3;;;;;;/h2*1-5H3;4*1H;;/q2*-1;;;;;2*+3/p-4
• InChIKey: AUBQNRPCZLEJIZ-UHFFFAOYSA-J
• XLogP: 8.65
• TPSA: 0.00 Ų
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	618.08
LogP ≤ 5	8.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)?

The IUPAC name of Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene) (CID 71310421) is bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene).

What is the SMILES notation for Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)?

The canonical SMILES for Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene) is Cc1c(C)c(C)[c-](C)c1C.Cc1c(C)c(C)[c-](C)c1C.Cl[Rh+]Cl.Cl[Rh+]Cl.

What is the InChIKey of Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)?

The InChIKey is AUBQNRPCZLEJIZ-UHFFFAOYSA-J. The full InChI is InChI=1S/2C10H15.4ClH.2Rh/c2*1-6-7(2)9(4)10(5)8(6)3;;;;;;/h2*1-5H3;4*1H;;/q2*-1;;;;;2*+3/p-4.

What are the key properties of Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene)?

Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene) has a molecular weight of 618.08 g/mol, XLogP of 8.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for Bis(dichlororhodium(1+));bis(1,2,3,4,5-pentamethylcyclopenta-1,3-diene) is sourced from PubChem (CID 71310421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 71310421 — identifiers, structure, computed properties (public domain)

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