tricopper;tris(dioxouranium(2+));tetraarsorate

As4Cu3O22U3 — CID 19854267

IUPACtricopper;tris(dioxouranium(2+));tetraarsorate
SMILESO=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[U+2]=O.O=[U+2]=O.O=[U+2]=O.[Cu+2].[Cu+2].[Cu+2]
InChIInChI=1S/4AsH3O4.3Cu.6O.3U/c4*2-1(3,4)5;;;;;;;;;;;;/h4*(H3,2,3,4,5);;;;;;;;;;;;/q;;;;3*+2;;;;;;;3*+2/p-12
InChIKeyYKPIBLSAFARYJW-UHFFFAOYSA-B
MW1556.39 g/mol
LogP-16.99
Rot. Bonds

About tricopper;tris(dioxouranium(2+));tetraarsorate

tricopper;tris(dioxouranium(2+));tetraarsorate (PubChem CID 19854267) has the molecular formula As4Cu3O22U3 and a molecular weight of 1556.39 g/mol. Its IUPAC name is tricopper;tris(dioxouranium(2+));tetraarsorate.

Molecular Properties

Compound Nametricopper;tris(dioxouranium(2+));tetraarsorate
PubChem CID19854267
Molecular FormulaAs4Cu3O22U3
Molecular Weight1556.39 g/mol
Exact Mass1554.52
IUPAC Nametricopper;tris(dioxouranium(2+));tetraarsorate
SMILESO=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[U+2]=O.O=[U+2]=O.O=[U+2]=O.[Cu+2].[Cu+2].[Cu+2]
InChIInChI=1S/4AsH3O4.3Cu.6O.3U/c4*2-1(3,4)5;;;;;;;;;;;;/h4*(H3,2,3,4,5);;;;;;;;;;;;/q;;;;3*+2;;;;;;;3*+2/p-12
InChIKeyYKPIBLSAFARYJW-UHFFFAOYSA-B
XLogP-16.99
TPSA447.42 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001556.39
LogP ≤ 5-16.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

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Related Compounds

tris(dioxouranium(2+)) diarsorate
CID 19854285
tricopper diarsorate
CID 26065
tris(nickel(2+)) diarsorate
CID 19786074
tris(zirconium(4+));tetraarsorate
CID 173165970
nickel(3+) arsorate
CID 57348043
diazanium;arsorate
CID 23618854
azanium;molybdenum(2+);arsorate
CID 174277284
tris(zirconium(4+));tetraarsorate;hydrate
CID 173447280
CID 175362021
CID 175362021
oxygen(2-);vanadium;arsorate
CID 173069015
pentacopper;sodium;hydrogen arsorate;triarsorate
CID 165361798
dioxouranium(2+) dibromide
CID 19002494

Frequently Asked Questions

What is the IUPAC name of tricopper;tris(dioxouranium(2+));tetraarsorate?
The IUPAC name of tricopper;tris(dioxouranium(2+));tetraarsorate (CID 19854267) is tricopper;tris(dioxouranium(2+));tetraarsorate.
What is the SMILES notation for tricopper;tris(dioxouranium(2+));tetraarsorate?
The canonical SMILES for tricopper;tris(dioxouranium(2+));tetraarsorate is O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].O=[U+2]=O.O=[U+2]=O.O=[U+2]=O.[Cu+2].[Cu+2].[Cu+2].
What is the InChIKey of tricopper;tris(dioxouranium(2+));tetraarsorate?
The InChIKey is YKPIBLSAFARYJW-UHFFFAOYSA-B. The full InChI is InChI=1S/4AsH3O4.3Cu.6O.3U/c4*2-1(3,4)5;;;;;;;;;;;;/h4*(H3,2,3,4,5);;;;;;;;;;;;/q;;;;3*+2;;;;;;;3*+2/p-12.
What are the key properties of tricopper;tris(dioxouranium(2+));tetraarsorate?
tricopper;tris(dioxouranium(2+));tetraarsorate has a molecular weight of 1556.39 g/mol, XLogP of -16.99, 0 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for tricopper;tris(dioxouranium(2+));tetraarsorate is sourced from PubChem (CID 19854267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).