tetrazinc;octaiodide

I8Zn4 — CID 175086444

IUPACtetrazinc;octaiodide
SMILES[I-].[I-].[I-].[I-].[I-].[I-].[I-].[I-].[Zn+2].[Zn+2].[Zn+2].[Zn+2]
InChIInChI=1S/8HI.4Zn/h8*1H;;;;/q;;;;;;;;4*+2/p-8
InChIKeyXXTLONRUMVDQDM-UHFFFAOYSA-F
MW1276.79 g/mol
LogP-23.98
Rot. Bonds

About tetrazinc;octaiodide

tetrazinc;octaiodide (PubChem CID 175086444) has the molecular formula I8Zn4 and a molecular weight of 1276.79 g/mol. Its IUPAC name is tetrazinc;octaiodide.

Molecular Properties

Compound Nametetrazinc;octaiodide
PubChem CID175086444
Molecular FormulaI8Zn4
Molecular Weight1276.79 g/mol
Exact Mass1270.95
IUPAC Nametetrazinc;octaiodide
SMILES[I-].[I-].[I-].[I-].[I-].[I-].[I-].[I-].[Zn+2].[Zn+2].[Zn+2].[Zn+2]
InChIInChI=1S/8HI.4Zn/h8*1H;;;;/q;;;;;;;;4*+2/p-8
InChIKeyXXTLONRUMVDQDM-UHFFFAOYSA-F
XLogP-23.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001276.79
LogP ≤ 5-23.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tetrazinc;octaiodide?
The IUPAC name of tetrazinc;octaiodide (CID 175086444) is tetrazinc;octaiodide.
What is the SMILES notation for tetrazinc;octaiodide?
The canonical SMILES for tetrazinc;octaiodide is [I-].[I-].[I-].[I-].[I-].[I-].[I-].[I-].[Zn+2].[Zn+2].[Zn+2].[Zn+2].
What is the InChIKey of tetrazinc;octaiodide?
The InChIKey is XXTLONRUMVDQDM-UHFFFAOYSA-F. The full InChI is InChI=1S/8HI.4Zn/h8*1H;;;;/q;;;;;;;;4*+2/p-8.
What are the key properties of tetrazinc;octaiodide?
tetrazinc;octaiodide has a molecular weight of 1276.79 g/mol, XLogP of -23.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrazinc;octaiodide is sourced from PubChem (CID 175086444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).