cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate

C32H26CoF12N6O2P2 — CID 139197646

About cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate

cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate (PubChem CID 139197646) has the molecular formula C32H26CoF12N6O2P2 and a molecular weight of 875.46 g/mol. Its IUPAC name is cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate.

Molecular Properties

• Compound Name: cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate
• PubChem CID: 139197646
• Molecular Formula: C32H26CoF12N6O2P2
• Molecular Weight: 875.46 g/mol
• Exact Mass: 875.07
• IUPAC Name: cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate
• SMILES: COc1cc(-c2ccccn2)nc(-c2ccccn2)c1.COc1cc(-c2ccccn2)nc(-c2ccccn2)c1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Co+2]
• InChI: InChI=1S/2C16H13N3O.Co.2F6P/c2*1-20-12-10-15(13-6-2-4-8-17-13)19-16(11-12)14-7-3-5-9-18-14;;2*1-7(2,3,4,5)6/h2*2-11H,1H3;;;/q;;+2;2*-1
• InChIKey: PHZLYYBDABTTIX-UHFFFAOYSA-N
• XLogP: 13.19
• TPSA: 95.80 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 55
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	875.46
LogP ≤ 5	13.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate?

The IUPAC name of cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate (CID 139197646) is cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate.

What is the SMILES notation for cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate?

The canonical SMILES for cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate is COc1cc(-c2ccccn2)nc(-c2ccccn2)c1.COc1cc(-c2ccccn2)nc(-c2ccccn2)c1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Co+2].

What is the InChIKey of cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate?

The InChIKey is PHZLYYBDABTTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H13N3O.Co.2F6P/c2*1-20-12-10-15(13-6-2-4-8-17-13)19-16(11-12)14-7-3-5-9-18-14;;2*1-7(2,3,4,5)6/h2*2-11H,1H3;;;/q;;+2;2*-1.

What are the key properties of cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate?

cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate has a molecular weight of 875.46 g/mol, XLogP of 13.19, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for cobalt(2+);bis(4-methoxy-2,6-dipyridin-2-ylpyridine);dihexafluorophosphate is sourced from PubChem (CID 139197646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).