bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate

C20H16Cl2Co2N4O10 — CID 139069368

IUPACbis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate
SMILES[Co+3].[Co+3].[O-2].[O-2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/2C10H8N2.2ClHO4.2Co.2O/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3,4)5;;;;/h2*1-8H;2*(H,2,3,4,5);;;;/q;;;;2*+3;2*-2/p-2
InChIKeyOHGPDIYICPAYNM-UHFFFAOYSA-L
MW661.14 g/mol
LogP-5.47
Rot. Bonds2

About bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate

bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate (PubChem CID 139069368) has the molecular formula C20H16Cl2Co2N4O10 and a molecular weight of 661.14 g/mol. Its IUPAC name is bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate.

Molecular Properties

Compound Namebis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate
PubChem CID139069368
Molecular FormulaC20H16Cl2Co2N4O10
Molecular Weight661.14 g/mol
Exact Mass659.89
IUPAC Namebis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate
SMILES[Co+3].[Co+3].[O-2].[O-2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/2C10H8N2.2ClHO4.2Co.2O/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3,4)5;;;;/h2*1-8H;2*(H,2,3,4,5);;;;/q;;;;2*+3;2*-2/p-2
InChIKeyOHGPDIYICPAYNM-UHFFFAOYSA-L
XLogP-5.47
TPSA293.04 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds2
Heavy Atoms38
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500661.14
LogP ≤ 5-5.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Frequently Asked Questions

What is the IUPAC name of bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate?
The IUPAC name of bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate (CID 139069368) is bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate.
What is the SMILES notation for bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate?
The canonical SMILES for bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate is [Co+3].[Co+3].[O-2].[O-2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate?
The InChIKey is OHGPDIYICPAYNM-UHFFFAOYSA-L. The full InChI is InChI=1S/2C10H8N2.2ClHO4.2Co.2O/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3,4)5;;;;/h2*1-8H;2*(H,2,3,4,5);;;;/q;;;;2*+3;2*-2/p-2.
What are the key properties of bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate?
bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate has a molecular weight of 661.14 g/mol, XLogP of -5.47, 2 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cobalt(3+));bis(oxygen(2-));bis(2-pyridin-2-ylpyridine);diperchlorate is sourced from PubChem (CID 139069368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).