dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))

Ba2Cu2O7Yb2 — CID 173185268

IUPACdicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))
SMILES[Ba+2].[Ba+2].[Cu+2].[Cu+2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Yb+3].[Yb+3]
InChIInChI=1S/2Ba.2Cu.7O.2Yb/q4*+2;7*-2;2*+3
InChIKeyZYIZTDBGVJDNOW-UHFFFAOYSA-N
MW859.82 g/mol
LogP-1.60
Rot. Bonds

About dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))

dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)) (PubChem CID 173185268) has the molecular formula Ba2Cu2O7Yb2 and a molecular weight of 859.82 g/mol. Its IUPAC name is dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)).

Molecular Properties

Compound Namedicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))
PubChem CID173185268
Molecular FormulaBa2Cu2O7Yb2
Molecular Weight859.82 g/mol
Exact Mass861.51
IUPAC Namedicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))
SMILES[Ba+2].[Ba+2].[Cu+2].[Cu+2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Yb+3].[Yb+3]
InChIInChI=1S/2Ba.2Cu.7O.2Yb/q4*+2;7*-2;2*+3
InChIKeyZYIZTDBGVJDNOW-UHFFFAOYSA-N
XLogP-1.60
TPSA199.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500859.82
LogP ≤ 5-1.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))?
The IUPAC name of dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)) (CID 173185268) is dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)).
What is the SMILES notation for dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))?
The canonical SMILES for dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)) is [Ba+2].[Ba+2].[Cu+2].[Cu+2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Yb+3].[Yb+3].
What is the InChIKey of dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))?
The InChIKey is ZYIZTDBGVJDNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/2Ba.2Cu.7O.2Yb/q4*+2;7*-2;2*+3.
What are the key properties of dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+))?
dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)) has a molecular weight of 859.82 g/mol, XLogP of -1.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicopper;bis(barium(2+));heptakis(oxygen(2-));bis(ytterbium(3+)) is sourced from PubChem (CID 173185268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).