diazanium;zirconium;carbonate

CH8N2O3Zr2 — CID 174529437

IUPACdiazanium;zirconium;carbonate
SMILESO=C([O-])[O-].[NH4+].[NH4+].[Zr].[Zr]
InChIInChI=1S/CH2O3.2H3N.2Zr/c2-1(3)4;;;;/h(H2,2,3,4);2*1H3;;
InChIKeyYVHFEYIKHKLASM-UHFFFAOYSA-N
MW278.53 g/mol
LogP-1.70
Rot. Bonds

About diazanium;zirconium;carbonate

diazanium;zirconium;carbonate (PubChem CID 174529437) has the molecular formula CH8N2O3Zr2 and a molecular weight of 278.53 g/mol. Its IUPAC name is diazanium;zirconium;carbonate.

Molecular Properties

Compound Namediazanium;zirconium;carbonate
PubChem CID174529437
Molecular FormulaCH8N2O3Zr2
Molecular Weight278.53 g/mol
Exact Mass275.86
IUPAC Namediazanium;zirconium;carbonate
SMILESO=C([O-])[O-].[NH4+].[NH4+].[Zr].[Zr]
InChIInChI=1S/CH2O3.2H3N.2Zr/c2-1(3)4;;;;/h(H2,2,3,4);2*1H3;;
InChIKeyYVHFEYIKHKLASM-UHFFFAOYSA-N
XLogP-1.70
TPSA136.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.53
LogP ≤ 5-1.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of diazanium;zirconium;carbonate?
The IUPAC name of diazanium;zirconium;carbonate (CID 174529437) is diazanium;zirconium;carbonate.
What is the SMILES notation for diazanium;zirconium;carbonate?
The canonical SMILES for diazanium;zirconium;carbonate is O=C([O-])[O-].[NH4+].[NH4+].[Zr].[Zr].
What is the InChIKey of diazanium;zirconium;carbonate?
The InChIKey is YVHFEYIKHKLASM-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O3.2H3N.2Zr/c2-1(3)4;;;;/h(H2,2,3,4);2*1H3;;.
What are the key properties of diazanium;zirconium;carbonate?
diazanium;zirconium;carbonate has a molecular weight of 278.53 g/mol, XLogP of -1.70, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diazanium;zirconium;carbonate is sourced from PubChem (CID 174529437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).