sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))

Ba2NaNb5O15 — CID 134068077

IUPACsodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))
SMILES[Ba+2].[Ba+2].[Na+].[Nb+5].[Nb+5].[Nb+5].[Nb+5].[Nb+5].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2]
InChIInChI=1S/2Ba.Na.5Nb.15O/q2*+2;+1;5*+5;15*-2
InChIKeySEQQXXCCTTVCHH-UHFFFAOYSA-N
MW1002.16 g/mol
LogP-5.55
Rot. Bonds

About sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))

sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)) (PubChem CID 134068077) has the molecular formula Ba2NaNb5O15 and a molecular weight of 1002.16 g/mol. Its IUPAC name is sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)).

Molecular Properties

Compound Namesodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))
PubChem CID134068077
Molecular FormulaBa2NaNb5O15
Molecular Weight1002.16 g/mol
Exact Mass1003.26
IUPAC Namesodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))
SMILES[Ba+2].[Ba+2].[Na+].[Nb+5].[Nb+5].[Nb+5].[Nb+5].[Nb+5].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2]
InChIInChI=1S/2Ba.Na.5Nb.15O/q2*+2;+1;5*+5;15*-2
InChIKeySEQQXXCCTTVCHH-UHFFFAOYSA-N
XLogP-5.55
TPSA427.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001002.16
LogP ≤ 5-5.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 25109538
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CID 6453061
argon;barium(2+);oxygen(2-)
CID 159738896
barium(2+);oxygen(2-);yttrium
CID 24968681
methane;bis(niobium(5+));pentakis(oxygen(2-))
CID 173492964
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CID 91866249

Frequently Asked Questions

What is the IUPAC name of sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))?
The IUPAC name of sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)) (CID 134068077) is sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)).
What is the SMILES notation for sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))?
The canonical SMILES for sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)) is [Ba+2].[Ba+2].[Na+].[Nb+5].[Nb+5].[Nb+5].[Nb+5].[Nb+5].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].
What is the InChIKey of sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))?
The InChIKey is SEQQXXCCTTVCHH-UHFFFAOYSA-N. The full InChI is InChI=1S/2Ba.Na.5Nb.15O/q2*+2;+1;5*+5;15*-2.
What are the key properties of sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-))?
sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)) has a molecular weight of 1002.16 g/mol, XLogP of -5.55, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;bis(barium(2+));pentakis(niobium(5+));pentadecakis(oxygen(2-)) is sourced from PubChem (CID 134068077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).