copper;molybdenum(4+);hexanitrate

CuMoN6O18 — CID 161448139

IUPACcopper;molybdenum(4+);hexanitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2].[Mo+4]
InChIInChI=1S/Cu.Mo.6NO3/c;;6*2-1(3)4/q+2;+4;6*-1
InChIKeyWADZJKYCSGYLAR-UHFFFAOYSA-N
MW531.51 g/mol
LogP-1.44
Rot. Bonds

About copper;molybdenum(4+);hexanitrate

copper;molybdenum(4+);hexanitrate (PubChem CID 161448139) has the molecular formula CuMoN6O18 and a molecular weight of 531.51 g/mol. Its IUPAC name is copper;molybdenum(4+);hexanitrate.

Molecular Properties

Compound Namecopper;molybdenum(4+);hexanitrate
PubChem CID161448139
Molecular FormulaCuMoN6O18
Molecular Weight531.51 g/mol
Exact Mass532.76
IUPAC Namecopper;molybdenum(4+);hexanitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2].[Mo+4]
InChIInChI=1S/Cu.Mo.6NO3/c;;6*2-1(3)4/q+2;+4;6*-1
InChIKeyWADZJKYCSGYLAR-UHFFFAOYSA-N
XLogP-1.44
TPSA397.20 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500531.51
LogP ≤ 5-1.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 160967915
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diazanium;copper;tetranitrate
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copper;cerium(3+);pentanitrate
CID 157222140
chloranium;copper;trinitrate
CID 172682071
copper;oxocopper;dinitrate
CID 158560469
europium(3+) trinitrate
CID 24983
technetium(7+) heptanitrate
CID 23031034
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ruthenium(3+) nitrate
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aluminum trinitrate
CID 26053
platinum pentanitrate
CID 173027999

Frequently Asked Questions

What is the IUPAC name of copper;molybdenum(4+);hexanitrate?
The IUPAC name of copper;molybdenum(4+);hexanitrate (CID 161448139) is copper;molybdenum(4+);hexanitrate.
What is the SMILES notation for copper;molybdenum(4+);hexanitrate?
The canonical SMILES for copper;molybdenum(4+);hexanitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2].[Mo+4].
What is the InChIKey of copper;molybdenum(4+);hexanitrate?
The InChIKey is WADZJKYCSGYLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/Cu.Mo.6NO3/c;;6*2-1(3)4/q+2;+4;6*-1.
What are the key properties of copper;molybdenum(4+);hexanitrate?
copper;molybdenum(4+);hexanitrate has a molecular weight of 531.51 g/mol, XLogP of -1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for copper;molybdenum(4+);hexanitrate is sourced from PubChem (CID 161448139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).