copper;indium(3+);oxidoselenonyl selenate

CuInO7Se2+3 — CID 158587722

IUPACcopper;indium(3+);oxidoselenonyl selenate
SMILESO=[Se](=O)([O-])O[Se](=O)(=O)[O-].[Cu+2].[In+3]
InChIInChI=1S/Cu.In.H2O7Se2/c;;1-8(2,3)7-9(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q+2;+3;/p-2
InChIKeyHUAPCCCESIPSNI-UHFFFAOYSA-L
MW448.28 g/mol
LogP-4.07
Rot. Bonds2

About copper;indium(3+);oxidoselenonyl selenate

copper;indium(3+);oxidoselenonyl selenate (PubChem CID 158587722) has the molecular formula CuInO7Se2+3 and a molecular weight of 448.28 g/mol. Its IUPAC name is copper;indium(3+);oxidoselenonyl selenate.

Molecular Properties

Compound Namecopper;indium(3+);oxidoselenonyl selenate
PubChem CID158587722
Molecular FormulaCuInO7Se2+3
Molecular Weight448.28 g/mol
Exact Mass449.63
IUPAC Namecopper;indium(3+);oxidoselenonyl selenate
SMILESO=[Se](=O)([O-])O[Se](=O)(=O)[O-].[Cu+2].[In+3]
InChIInChI=1S/Cu.In.H2O7Se2/c;;1-8(2,3)7-9(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q+2;+3;/p-2
InChIKeyHUAPCCCESIPSNI-UHFFFAOYSA-L
XLogP-4.07
TPSA123.63 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.28
LogP ≤ 5-4.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

Copper;indium(3+);oxidoseleninyl selenite
CID 160371283
Copper;indium(3+);selenate
CID 161821521
Dicopper;bis(indium(3+));pentaselenite
CID 173052086

Frequently Asked Questions

What is the IUPAC name of copper;indium(3+);oxidoselenonyl selenate?
The IUPAC name of copper;indium(3+);oxidoselenonyl selenate (CID 158587722) is copper;indium(3+);oxidoselenonyl selenate.
What is the SMILES notation for copper;indium(3+);oxidoselenonyl selenate?
The canonical SMILES for copper;indium(3+);oxidoselenonyl selenate is O=[Se](=O)([O-])O[Se](=O)(=O)[O-].[Cu+2].[In+3].
What is the InChIKey of copper;indium(3+);oxidoselenonyl selenate?
The InChIKey is HUAPCCCESIPSNI-UHFFFAOYSA-L. The full InChI is InChI=1S/Cu.In.H2O7Se2/c;;1-8(2,3)7-9(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q+2;+3;/p-2.
What are the key properties of copper;indium(3+);oxidoselenonyl selenate?
copper;indium(3+);oxidoselenonyl selenate has a molecular weight of 448.28 g/mol, XLogP of -4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for copper;indium(3+);oxidoselenonyl selenate is sourced from PubChem (CID 158587722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).