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

CaCdCr5CuO20Zn2 — CID 159500133

IUPACcalcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)
SMILESO=[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]
InChIInChI=1S/Ca.Cd.5Cr.Cu.20O.2Zn/q2*+2;;;;;;+2;;;;;;;;;;;10*-1;2*+2
InChIKeyCRZKONADNDQIRW-UHFFFAOYSA-N
MW926.78 g/mol
LogP-13.48
Rot. Bonds

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 Namecalcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)
PubChem CID159500133
Molecular FormulaCaCdCr5CuO20Zn2
Molecular Weight926.78 g/mol
Exact Mass924.25
IUPAC Namecalcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium)
SMILESO=[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]
InChIInChI=1S/Ca.Cd.5Cr.Cu.20O.2Zn/q2*+2;;;;;;+2;;;;;;;;;;;10*-1;2*+2
InChIKeyCRZKONADNDQIRW-UHFFFAOYSA-N
XLogP-13.48
TPSA401.30 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500926.78
LogP ≤ 5-13.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze calcium;copper;dizinc;cadmium(2+);pentakis(dioxido(dioxo)chromium) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

copper;zinc;bis(dioxido(dioxo)chromium)
CID 20544351
calcium;copper;dizinc;cadmium(2+);dioxido(dioxo)chromium;sulfate
CID 160835923
dicalcium bis(dioxido(dioxo)chromium)
CID 159677677
undecacopper;decazinc;copper;hexakis(dioxido(dioxo)chromium);heptadecakis(oxygen(2-))
CID 138394587
dicalcium;copper;cadmium(2+);dioxido(dioxo)chromium;sulfate
CID 172702995
dicalcium;dicopper;dizinc;tris(dioxido(dioxo)chromium);trisulfate
CID 173097154
diazanium;copper;bis(dioxido(dioxo)chromium)
CID 23293307
zinc;dioxido(dioxo)chromium;hydroxide
CID 76957358
copper;cobalt(2+);bis(dioxido(dioxo)chromium)
CID 159114574
strontium;zinc;bis(dioxido(dioxo)chromium)
CID 158040204
dipotassium;dizinc;tris(dioxido(dioxo)chromium)
CID 6451690
trizinc;bis(dioxido(dioxo)chromium);dihydroxide
CID 6452151

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).