CID 118856442

Sb4Zr3+12 — CID 118856442

IUPAC—
SMILES[Sb].[Sb].[Sb].[Sb].[Zr+4].[Zr+4].[Zr+4]
InChIInChI=1S/4Sb.3Zr/q;;;;3*+4
InChIKeyRCGOREOXAJZRBB-UHFFFAOYSA-N
MW760.71 g/mol
LogP-1.53
Rot. Bonds

About CID 118856442

CID 118856442 (PubChem CID 118856442) has the molecular formula Sb4Zr3+12 and a molecular weight of 760.71 g/mol.

Molecular Properties

Compound NameCID 118856442
PubChem CID118856442
Molecular FormulaSb4Zr3+12
Molecular Weight760.71 g/mol
Exact Mass753.32
IUPAC Name—
SMILES[Sb].[Sb].[Sb].[Sb].[Zr+4].[Zr+4].[Zr+4]
InChIInChI=1S/4Sb.3Zr/q;;;;3*+4
InChIKeyRCGOREOXAJZRBB-UHFFFAOYSA-N
XLogP-1.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500760.71
LogP ≤ 5-1.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 118856442?
The IUPAC name of CID 118856442 (CID 118856442) is not available.
What is the SMILES notation for CID 118856442?
The canonical SMILES for CID 118856442 is [Sb].[Sb].[Sb].[Sb].[Zr+4].[Zr+4].[Zr+4].
What is the InChIKey of CID 118856442?
The InChIKey is RCGOREOXAJZRBB-UHFFFAOYSA-N. The full InChI is InChI=1S/4Sb.3Zr/q;;;;3*+4.
What are the key properties of CID 118856442?
CID 118856442 has a molecular weight of 760.71 g/mol, XLogP of -1.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 118856442 is sourced from PubChem (CID 118856442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).