bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))

Cr2O7Tl2 — CID 139207617

IUPACbis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))
SMILES[Cr+4].[Cr+4].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Tl+3].[Tl+3]
InChIInChI=1S/2Cr.7O.2Tl/q2*+4;7*-2;2*+3
InChIKeyKZRJZUDGRPJJKI-UHFFFAOYSA-N
MW624.75 g/mol
LogP-1.60
Rot. Bonds

About bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))

bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)) (PubChem CID 139207617) has the molecular formula Cr2O7Tl2 and a molecular weight of 624.75 g/mol. Its IUPAC name is bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)).

Molecular Properties

Compound Namebis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))
PubChem CID139207617
Molecular FormulaCr2O7Tl2
Molecular Weight624.75 g/mol
Exact Mass625.79
IUPAC Namebis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))
SMILES[Cr+4].[Cr+4].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Tl+3].[Tl+3]
InChIInChI=1S/2Cr.7O.2Tl/q2*+4;7*-2;2*+3
InChIKeyKZRJZUDGRPJJKI-UHFFFAOYSA-N
XLogP-1.60
TPSA199.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500624.75
LogP ≤ 5-1.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))?
The IUPAC name of bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)) (CID 139207617) is bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)).
What is the SMILES notation for bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))?
The canonical SMILES for bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)) is [Cr+4].[Cr+4].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Tl+3].[Tl+3].
What is the InChIKey of bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))?
The InChIKey is KZRJZUDGRPJJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/2Cr.7O.2Tl/q2*+4;7*-2;2*+3.
What are the key properties of bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+))?
bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)) has a molecular weight of 624.75 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 bis(chromium(4+));heptakis(oxygen(2-));bis(thallium(3+)) is sourced from PubChem (CID 139207617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).