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Cyclooctadiene Rhodium Chloride Dimer
CAS: 12092-47-6 | C16H24Cl2Rh2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12092-47-6
Molecular Formula:
C16H24Cl2Rh2
Molecular Mass:
493.09 g/mol
Names and Synonyms:
Cyclooctadiene Rhodium Chloride Dimer
Rhodium, di-μ-chlorobis[(1,2,5,6-η)-1,5-cyclooctadiene]di-
Rhodium, di-μ-chlorobis(1,5-cyclooctadiene)di-
Rhodium, dichlorobis(1,5-cyclooctadiene)di-
1,5-Cyclooctadiene, rhodium complex
Di-μ-chlorobis[(1,2,5,6-η)-1,5-cyclooctadiene]dirhodium
Rhodium 1,5-cyclooctadiene chloride dimer
Di-μ-Chlorobis(1,5-cyclooctadiene)dirhodium
Chloro(1,5-cyclooctadiene)rhodium dimer
Dichlorobis(cyclooctadiene)dirhodium
Dichlorobis(1,5-cyclooctadiene)dirhodium
Bis(μ-chloro)bis(1,5-cyclooctadiene)dirhodium
Chloro(cyclooctadiene)rhodium dimer
Cyclooctadiene rhodium chloride dimer
Di-μ-chlorobis(cyclooctadiene)dirhodium
(1,5-Cyclooctadiene)rhodium chloride dimer
Chlororhodium (1,5-cyclooctadiene) dimer
Bis(chloro(1,5-cyclooctadiene)rhodium)
Bis(1,5-cyclooctadiene)dirhodium dichloride
Di-μ-chlorobis(η4-1,5-cyclooctadiene)dirhodium
Bis((1,5-cyclooctadiene)(chloro)rhodium)
(η4-1,5-Cyclooctadiene)rhodium chloride dimer
(1,5-Cyclooctadiene)rhodium(I) chloride dimer
Bis((μ-chloro)(η4-1,5-cyclooctadiene)rhodium)
μ-Chloro(1,5-cyclooctadiene)rhodium(I) dimer
Bis(chloro(η4-1,5-cyclooctadiene)rhodium)
[Rh(COD)Cl]2
Di-μ-chlorobis(η4-1,5-cyclooctadiene)dirhodium(I)
Dichlorobis(1,5-cyclooctadiene)rhodium(I)
Bis(μ2-chloro)bis(1,5-cyclooctadiene)dirhodium
Bis(cyclooctadienerhodium chloride)
Bis(μ-chloro)bis[(1,5-cyclooctadiene)rhodium]
Di-μ2-chlorobis(1,5-cyclooctadiene)dirhodium
Di-μ-chlorobis[(1,5-cyclooctadiene)rhodium]
Bis(cyclooctadiene)dichlorodirhodium
Chloro(1,5-cyclooctadiene)rhodium (I) dimer
[Rh(1,5-cod)Cl]2
Identifiers:
SMILES:
C1=CCCC=CCC1.C1=CCCC=CCC1.[Cl-].[Cl-].[Rh+].[Rh+]
InChI:
InChI=1S/2C8H12.2ClH.2Rh/c2*1-2-4-6-8-7-5-3-1;;;;/h2*1-2,7-8H,3-6H2;2*1H;;/q;;;;2*+1/p-2
Key Properties
Melting Point
224-226 °C (decomp)
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 493.09 g/mol | CAS Common Chemistry |
| 493.08599999999996 g/mol | RDKit | |
| 491.936514128 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Cyclooctadiene_rhodium_chloride_dimer | CAS Common Chemistry |
| Canonical SMILES | [Cl-]1[Rh+]234([Cl-][Rh+]1567[CH]=8CC[CH]7=[CH]6CC[CH]85)[CH]=9CC[CH]4=[CH]3CC[CH]92 | CAS Common Chemistry |
| InChI | InChI=1S/2C8H12.2ClH.2Rh/c2*1-2-4-6-8-7-5-3-1;;;;/h2*1-2,7-8H,3-6H2;2*1H;;/q;;;;2*+1/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=QSUDXYGZLAJAQU-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 224-226 °C (decomp) | CAS Common Chemistry |
| Name | Di-μ-chlorobis[(1,2,5,6-η)-1,5-cyclooctadiene]dirhodium | CAS Common Chemistry |
| Cyclooctadiene rhodium chloride dimer | CAS Common Chemistry | |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -0.6513999999999978 | RDKit |
| Molar Refractivity | 73.49600000000004 | RDKit |
