Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)

CaCdCr₅CuO₂₀Zn₂ — CID 159500133

About Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)

Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium) (PubChem CID 159500133) has the molecular formula CaCdCr₅CuO₂₀Zn₂ and a molecular weight of 926.78 g/mol. Its IUPAC name is calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium).

Molecular Properties

• Compound Name: Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)
• PubChem CID: 159500133
• Molecular Formula: CaCdCr₅CuO₂₀Zn₂
• Molecular Weight: 926.78 g/mol
• Exact Mass: 924.25
• IUPAC Name: calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)
• SMILES: O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].[Ca+2].[Cd+2].[Cu+2].[Zn+2].[Zn+2]
• InChI: InChI=1S/Ca.Cd.5Cr.Cu.20O.2Zn/q2*+2;;;;;;+2;;;;;;;;;;;10*-1;2*+2
• InChIKey: CRZKONADNDQIRW-UHFFFAOYSA-N
• XLogP: -13.48
• TPSA: 401.30 Ų
• H-Bond Acceptors: 20
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	926.78
LogP ≤ 5	-13.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)?

The IUPAC name of Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium) (CID 159500133) is calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium).

What is the SMILES notation for Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)?

The canonical SMILES for Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium) is O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].O=[Cr](=O)([O-])[O-].[Ca+2].[Cd+2].[Cu+2].[Zn+2].[Zn+2].

What is the InChIKey of Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)?

The InChIKey is CRZKONADNDQIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.Cd.5Cr.Cu.20O.2Zn/q2*+2;;;;;;+2;;;;;;;;;;;10*-1;2*+2.

What are the key properties of Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)?

Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium) has a molecular weight of 926.78 g/mol, XLogP of -13.48, 0 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for Calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium) is sourced from PubChem (CID 159500133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159500133 — identifiers, structure, computed properties (public domain)

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