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Molecule
Copper Molybdenum Oxide (Cumoo4)
CAS: 13767-34-5 · CuMoO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 13767-34-5
- Molecular Formula
- CuMoO
- Molecular Mass
- 175.48499999999999 g/mol
Identifiers
CAS Registry Number
13767-34-5
SMILES
[Cu].[Mo].[O]
InChI Key
PVGRIQYJDHKRFC-UHFFFAOYSA-N
InChI
InChI=1S/Cu.Mo.O
Names and Synonyms
- Copper Molybdenum Oxide (Cumoo4) Synonym
- Copper molybdenum oxide (CuMoO4) Synonym
- Molybdic acid (H2MoO4), copper(2+) salt (1:1) Synonym
- Copper molybdate(VI) (Cu(MoO4)) Synonym
- Copper molybdate (CuMoO4) Synonym
- Copper molybdate Synonym
- Cupric molybdate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Canonical SMILES | [O].[Cu].[Mo] | CAS Common Chemistry |
| InChI | InChI=1S/Cu.Mo.O | CAS Common Chemistry |
| InChI Key | InChIKey=PVGRIQYJDHKRFC-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Copper molybdenum oxide (CuMoO4) | CAS Common Chemistry |
| Molecular Mass | 175.48499999999999 g/mol | RDKit |
| 176.82992032 g/mol | RDKit | |
| 175.485 g/mol | RDKit | |
| 180.535 g/mol | chempirical lib | |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 28.5 Ų | RDKit |
| LogP | -0.12380000000000001 | RDKit |
| -0.1238 | RDKit | |
| Molar Refractivity | 0.6865 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 175.48 g/mol | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
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120
100
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 175.48 g/mol. Edit any field — others recompute live.
