molybdenum(4+);tetrakis(pyridine-2-carboxylate)

C24H16MoN4O8 — CID 160756221

IUPACmolybdenum(4+);tetrakis(pyridine-2-carboxylate)
SMILESO=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.[Mo+4]
InChIInChI=1S/4C6H5NO2.Mo/c4*8-6(9)5-3-1-2-4-7-5;/h4*1-4H,(H,8,9);/q;;;;+4/p-4
InChIKeyRXLWJNVAFNRCSK-UHFFFAOYSA-J
MW584.35 g/mol
LogP-2.22
Rot. Bonds4

About molybdenum(4+);tetrakis(pyridine-2-carboxylate)

molybdenum(4+);tetrakis(pyridine-2-carboxylate) (PubChem CID 160756221) has the molecular formula C24H16MoN4O8 and a molecular weight of 584.35 g/mol. Its IUPAC name is molybdenum(4+);tetrakis(pyridine-2-carboxylate).

Molecular Properties

Compound Namemolybdenum(4+);tetrakis(pyridine-2-carboxylate)
PubChem CID160756221
Molecular FormulaC24H16MoN4O8
Molecular Weight584.35 g/mol
Exact Mass586.00
IUPAC Namemolybdenum(4+);tetrakis(pyridine-2-carboxylate)
SMILESO=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.[Mo+4]
InChIInChI=1S/4C6H5NO2.Mo/c4*8-6(9)5-3-1-2-4-7-5;/h4*1-4H,(H,8,9);/q;;;;+4/p-4
InChIKeyRXLWJNVAFNRCSK-UHFFFAOYSA-J
XLogP-2.22
TPSA212.08 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500584.35
LogP ≤ 5-2.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Related Compounds

Chromium(III) picolinate
CID 151932
Zinc Picolinate
CID 9904746
Chromium tripicolinate
CID 56840998
Ferric picolinate
CID 11247217
Copper(II) picolinate
CID 14963587
Chromium picolinate monohydrate
CID 22833491
Bis(2-(4,6-difluorophenyl)pyridinato-C2,N)(picolinato)iridium(III)
CID 71306701
copper;N-(pyridine-2-carbonyl)pyridine-2-carboximidate;dihydrate
CID 50897049
Vanadium picolinate
CID 129717522
Calcium dipicolinate trihydrate
CID 129655055
Manganous picolinate
CID 9817756
Oxobis(picolinato)vanadium
CID 136227747

Frequently Asked Questions

What is the IUPAC name of molybdenum(4+);tetrakis(pyridine-2-carboxylate)?
The IUPAC name of molybdenum(4+);tetrakis(pyridine-2-carboxylate) (CID 160756221) is molybdenum(4+);tetrakis(pyridine-2-carboxylate).
What is the SMILES notation for molybdenum(4+);tetrakis(pyridine-2-carboxylate)?
The canonical SMILES for molybdenum(4+);tetrakis(pyridine-2-carboxylate) is O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.[Mo+4].
What is the InChIKey of molybdenum(4+);tetrakis(pyridine-2-carboxylate)?
The InChIKey is RXLWJNVAFNRCSK-UHFFFAOYSA-J. The full InChI is InChI=1S/4C6H5NO2.Mo/c4*8-6(9)5-3-1-2-4-7-5;/h4*1-4H,(H,8,9);/q;;;;+4/p-4.
What are the key properties of molybdenum(4+);tetrakis(pyridine-2-carboxylate)?
molybdenum(4+);tetrakis(pyridine-2-carboxylate) has a molecular weight of 584.35 g/mol, XLogP of -2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for molybdenum(4+);tetrakis(pyridine-2-carboxylate) is sourced from PubChem (CID 160756221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).