dicesium;copper(1+);carbonate;iodide

CCs2CuIO3 — CID 155885125

IUPACdicesium;copper(1+);carbonate;iodide
SMILESO=C([O-])[O-].[Cs+].[Cs+].[Cu+].[I-]
InChIInChI=1S/CH2O3.2Cs.Cu.HI/c2-1(3)4;;;;/h(H2,2,3,4);;;;1H/q;3*+1;/p-3
InChIKeyDDHGAUIUNBJEDT-UHFFFAOYSA-K
MW516.27 g/mol
LogP-11.44
Rot. Bonds

About dicesium;copper(1+);carbonate;iodide

dicesium;copper(1+);carbonate;iodide (PubChem CID 155885125) has the molecular formula CCs2CuIO3 and a molecular weight of 516.27 g/mol. Its IUPAC name is dicesium;copper(1+);carbonate;iodide.

Molecular Properties

Compound Namedicesium;copper(1+);carbonate;iodide
PubChem CID155885125
Molecular FormulaCCs2CuIO3
Molecular Weight516.27 g/mol
Exact Mass515.63
IUPAC Namedicesium;copper(1+);carbonate;iodide
SMILESO=C([O-])[O-].[Cs+].[Cs+].[Cu+].[I-]
InChIInChI=1S/CH2O3.2Cs.Cu.HI/c2-1(3)4;;;;/h(H2,2,3,4);;;;1H/q;3*+1;/p-3
InChIKeyDDHGAUIUNBJEDT-UHFFFAOYSA-K
XLogP-11.44
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500516.27
LogP ≤ 5-11.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of dicesium;copper(1+);carbonate;iodide?
The IUPAC name of dicesium;copper(1+);carbonate;iodide (CID 155885125) is dicesium;copper(1+);carbonate;iodide.
What is the SMILES notation for dicesium;copper(1+);carbonate;iodide?
The canonical SMILES for dicesium;copper(1+);carbonate;iodide is O=C([O-])[O-].[Cs+].[Cs+].[Cu+].[I-].
What is the InChIKey of dicesium;copper(1+);carbonate;iodide?
The InChIKey is DDHGAUIUNBJEDT-UHFFFAOYSA-K. The full InChI is InChI=1S/CH2O3.2Cs.Cu.HI/c2-1(3)4;;;;/h(H2,2,3,4);;;;1H/q;3*+1;/p-3.
What are the key properties of dicesium;copper(1+);carbonate;iodide?
dicesium;copper(1+);carbonate;iodide has a molecular weight of 516.27 g/mol, XLogP of -11.44, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dicesium;copper(1+);carbonate;iodide is sourced from PubChem (CID 155885125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).