Cadmium chloride#Crystal structure

{{chembox

|Verifiedfields = changed

|Watchedfields = changed

|verifiedrevid = 448989809

|Name = Cadmium chloride

|ImageFileL1 = Cadmium-chloride-3D-balls.png

|ImageNameL1 = Ball-and-stick model of cadmium chloride

|ImageSizeL1 = 120px

|ImageFileR1 = Cadmium-chloride-3D-polyhedra.png

|ImageNameR1 = Cadmium chloride in polyhedron shape

|ImageSizeR1 = 120px

|ImageFile2 = Cadmium chloride hemipentahydrate.jpg

|ImageName2 = Cadmium chloride hemipentahydrate

|ImageSize2 = 200px

|IUPACName = Cadmium dichloride

|OtherNames = Cadmium(II) chloride

|Section1={{Chembox Identifiers

|CASNo = 10108-64-2

|CASNo_Ref = {{cascite|correct|CAS}}

|CASNo1_Ref = {{cascite|correct|CAS}}

|CASNo1 = 7790-78-5

|CASNo2 = 35658-65-2

|index1_label = (hemipentahydrate)

|index2_label = (monohydrate)

|Beilstein = 3902835

|ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}

|ChemSpiderID = 23035

|ChemSpiderID1 = 17339510

|ChemSpiderID2 = 4447434

|DTXSID1 = DTXSID4040183

|ChEBI_Ref = {{ebicite|correct|EBI}}

|ChEBI = 35456

|KEGG = C15233

|EINECS = 233-296-7

|EC_number1 = 813-696-3

|Gmelin = 912918

|RTECS = EV0175000

|UNNumber = 2570

|PubChem = 24947

|PubChem1 = 24978551

|PubChem2=5284356

|UNII_Ref = {{fdacite|correct|FDA}}

|UNII = J6K4F9V3BA

|UNII1_Ref = {{fdacite|correct|FDA}}

|UNII1 = 2R707SXC9H

|InChI = 1/Cd.2ClH/h;2*1H/q+2;;/p-2

|InChIKey = YKYOUMDCQGMQQO-NUQVWONBAG

|StdInChI_Ref = {{stdinchicite|correct|chemspider}}

|StdInChI = 1S/Cd.2ClH/h;2*1H/q+2;;/p-2

|StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}

|StdInChIKey = YKYOUMDCQGMQQO-UHFFFAOYSA-L

|InChI2=1S/Cd.2ClH.H2O/h;2*1H;1H2/q+2;;;/p-2

|InChIKey2=OISMQLUZKQIKII-UHFFFAOYSA-L

|SMILES2 = O.[Cl-].[Cl-].[Cd+2]

|SMILES = [Cd+2].[Cl-].[Cl-]

|InChI1=1S/2Cd.4ClH.5H2O/h;;4*1H;5*1H2/q2*+2;;;;;;;;;/p-4

|InChIKey1=DZVRGWYMCGLNKJ-UHFFFAOYSA-J

|SMILES1 = O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Cl-].[Cd+2].[Cd+2]

}}

|Section2={{Chembox Properties

|Cd=1 | Cl=2

|Appearance = White solid, hygroscopic

|Odor = Odorless

|Density = 4.047 g/cm3 (anhydrous)
3.26 g/cm3 (monohydrate)
3.327 g/cm3 (Hemipentahydrate){{CRC90}}

|Solubility = Hemipentahydrate:
79.5 g/100 mL (−10 °C)
90 g/100 mL (0 °C)
Monohydrate:
119.6 g/100 mL (25 °C)
134.3 g/100 mL (40 °C)
134.2 g/100 mL (60 °C)
147 g/100 mL (100 °C){{cite book|last1 = Seidell|first1 = Atherton|last2 = Linke|first2 = William F.|year = 1919|title = Solubilities of Inorganic and Organic Compounds|url = https://archive.org/details/solubilitiesino01seidgoog|publisher = D. Van Nostrand Company|place = New York|edition = 2nd|page = [https://archive.org/details/solubilitiesino01seidgoog/page/n198 169]}}

|SolubleOther = Soluble in alcohol, selenium(IV) oxychloride, benzonitrile
Insoluble in ether, acetone

|MeltingPtC = 568

|MeltingPt_notes =

|BoilingPtC = 964

|BoilingPt_notes =

|Solubility1 = 4.6 g/kg (0 °C)
7.9 g/kg (4 °C)
8.1 g/kg (15 °C)
6.7 g/kg (30 °C)
5 g/kg (100 °C){{cite web |last= Anatolievich |first= Kiper Ruslan |website=chemister.ru |url= http://chemister.ru/Database/properties-en.php?dbid=1&id=75 |title = cadmium chloride |access-date = 2014-06-25}}

|Solvent1 = pyridine

|Solubility2 = 1.3 g/100 g (10 °C)
1.48 g/100 g (20 °C)
1.91 g/100 g (40 °C)
2.53 g/100 g (70 °C)

|Solvent2 = ethanol

|Solubility3 = 18 g/100 g (25 °C)

|Solvent3 = dimethyl sulfoxide

|VaporPressure = 0.01 kPa (471 °C)
0.1 kPa (541 °C)

|Viscosity = 2.31 cP (597 °C)
1.87 cP (687 °C)

|MagSus = −6.87·10−5 cm3/mol

}}

|Section3={{Chembox Structure

|CrystalStruct = Rhombohedral, hR9 (anhydrous){{cite web|title = Cadmium Chloride - CdCl2|url = http://wwwchem.uwimona.edu.jm/courses/cdcl2J.html|website =chem.uwimona.edu.jm|publisher = The University of the West Indies|place = Mona, Jamaica|access-date = 2014-06-25}}
Monoclinic (hemipentahydrate)

|SpaceGroup = R{{overline|3}}m, No. 166 (anhydrous)

|PointGroup = {{overline|3}} 2/m (anhydrous)

|LattConst_a = 3.846 Å

|LattConst_c = 17.479 Å (anhydrous)

|LattConst_gamma = 120

}}

|Section4={{Chembox Thermochemistry

|HeatCapacity = 74.7 J/mol·K

|Entropy = 115.3 J/mol·K

|DeltaHf = −391.5 kJ/mol

|DeltaGf = −343.9 kJ/mol

}}

|Section7={{Chembox Hazards

|ExternalSDS = [http://hazard.com/msds/mf/baker/baker/files/c0099.htm External MSDS]

|GHSPictograms = {{GHS06}}{{GHS08}}{{GHS09}}{{Sigma-Aldrich|id=202908|name=Cadmium chloride|accessdate=2014-05-23}}

|GHSSignalWord = Danger

|HPhrases = {{H-phrases|301|330|340|350|360|372|410}}

|PPhrases = {{P-phrases|210|260|273|284|301+310|310}}

|NFPA-H = 4

|NFPA-F = 0

|NFPA-R = 0

|LD50 = 94 mg/kg (rats, oral)
60 mg/kg (mouse, oral)
88 mg/kg (rat, oral){{IDLH|7440439|Cadmium compounds (as Cd)}}

|REL = Ca{{PGCH|0087}}

|PEL = [1910.1027] TWA 0.005 mg/m3 (as Cd)

|IDLH = Ca [9 mg/m3 (as Cd)]

}}

|Section8={{Chembox Related

|OtherAnions = Cadmium fluoride
Cadmium bromide
Cadmium iodide

|OtherCations = Zinc chloride
Mercury(II) chloride
Calcium chloride

}}

}}

Cadmium chloride is a white crystalline compound of cadmium and chloride, with the formula CdCl2. This salt is a hygroscopic solid that is highly soluble in water and slightly soluble in alcohol. The crystal structure of cadmium chloride (described below), is a reference for describing other crystal structures. Also known are CdCl2•H2O and the hemipentahydrate CdCl2•2.5H2O.

==Structure==

=Anhydrous=

Anhydrous cadmium chloride forms a layered structure consisting of octahedral Cd2+ centers linked with chloride ligands. Cadmium iodide, CdI2, has a similar structure, but the iodide ions are arranged in a HCP lattice, whereas in CdCl2 the chloride ions are arranged in a CCP lattice.N. N. Greenwood, A. Earnshaw, Chemistry of the Elements, 2nd ed., Butterworth-Heinemann, Oxford, UK, 1997.A. F. Wells, Structural Inorganic Chemistry, 5th ed., Oxford University Press, Oxford, UK, 1984.

=Hydrates=

File:1843-ICSD.png

The anhydrous form absorbs moisture from the air to form various hydrates. Three of these hydrates have been examined by X-ray crystallography.

class="wikitable plainrowheaders"

|+ Crystallographic data for the 3 hydrates of cadmium chloride

!Compound

!CdCl2·H2O{{cite journal |author1=H. Leligny |author2=J. C. Monier |title=Structure cristalline de CdCl2.H2O |journal=Acta Crystallographica B |date=1974 |volume=30 |issue=2|pages=305–309 |doi=10.1107/S056774087400272X |bibcode=1974AcCrB..30..305L |trans-title=Crystal structure of CdCl2.H2O |language=fr}}

!CdCl2·2.5H2O{{cite journal |author1=H. Leligny |author2=J. C. Monier |title=Structure de CdCl2.2,5H2O|journal=Acta Crystallographica B |date=1975 |volume=31 |issue=3|pages=728–732 |doi=10.1107/S056774087500369X |bibcode=1975AcCrB..31..728L |trans-title=Structure of CdCl2.2,5H2O |language=fr}}

!CdCl2·4H2O{{cite journal |author1=H. Leligny |author2=J. C. Monier |title=Structure de dichlorure de cadmium tétrahydraté|journal=Acta Crystallographica B |date=1979 |volume=35 |issue=3|pages=569–573 |doi=10.1107/S0567740879004179 |bibcode=1979AcCrB..35..569L |trans-title=Structure of cadmium dichloride tetrahydrate|language=fr}}

Molar mass (g/mol)

|201.33

|228.36

|255.38

Crystal Structure

|Orthorhombic

|Monoclinic

|Orthorhombic

Space Group

|Pnma

|P21/n

|P212121

Lattice constant a (Å)

|9.25

|9.21

|12.89

Lattice constant b (Å)

|3.78

|11.88

|7.28

Lattice constant c (Å)

|11.89

|10.08

|15.01

β

|

|93.5°

|

Density (g/cm3)

|3.26

|2.84

|2.41

Comment

|Interconnected CdCl3(H2O) octahederons

|

|Distorted trans-[CdCl2(H2O)4] octahedrons

Chemical properties

Cadmium chloride dissolves well in water and other polar solvents. It is a mild Lewis acid.

:CdCl2 + 2 Cl → [CdCl4]2−

Solutions of equimolar cadmium chloride and potassium chloride give potassium cadmium trichloride.{{cite book|author1=F. Wagenknecht|author2=R. Juza|chapter=Potassium cadmium chloride|title=Handbook of Preparative Inorganic Chemistry, 2nd Ed. |editor=G. Brauer|publisher=Academic Press|year=1963|place=NY, NY|volume=2|pages=1095}}

With large cations, it is possible to isolate the trigonal bipyramidal [CdCl5]3− ion.

Cadmium metal is soluble in molten cadmium chloride, produced by heating cadmium chloride above 568 °C. Upon cooling, the metal precipitates.

Preparation

Anhydrous cadmium chloride can be prepared by the reaction of hydrochloric acid and cadmium metal or cadmium oxide.{{cite book |author1=Karl-Heinz Schulte-Schrepping |author2=Magnus Piscator |title=Ullmann's Encyclopedia of Industrial Chemistry |date=2000 |isbn=9783527306732 |page=472 |edition=6th |url=https://doi.org/10.1002/14356007.a04_499 |language=en |chapter=Cadmium and Cadmium Compounds|doi=10.1002/14356007.a04_499 }}

: Cd + 2 HCl → CdCl2 + H2

The anhydrous salt can also be prepared from anhydrous cadmium acetate using hydrogen chloride or acetyl chloride.{{cite book|author1=F. Wagenknecht|author2=R. Juza|chapter=Cadmium chloride|title=Handbook of Preparative Inorganic Chemistry, 2nd Ed. |editor=G. Brauer|publisher=Academic Press|year=1963|place=NY, NY|volume=2|pages=1093–4}}

Industrially, it is produced by the reaction of molten cadmium and chlorine gas at 600 °C.

The monohydrate, hemipentahydrate, and tetrahydrate can be produced by evaporation of the solution of cadmium chloride at 35, 20, and 0 °C respectively. The hemipentahydrate and tetrahydrate release water in air.

Uses

Cadmium chloride is used for the preparation of cadmium sulfide, used as "cadmium yellow", a brilliant-yellow stable inorganic pigment.

:{{chem|CdCl|2}} + {{chem|H|2|S}} → {{chem|CdS}} + 2 HCl

In the laboratory, anhydrous CdCl2 can be used for the preparation of organocadmium compounds of the type R2Cd, where R is an aryl or a primary alkyl. These were once used in the synthesis of ketones from acyl chlorides:J. March, Advanced Organic Chemistry, 4th ed., p. 723, Wiley, New York, 1992.

: {{chem|CdCl|2}} + 2 RMgX → {{chem|R|2|Cd}} + {{chem|MgCl|2}} + {{chem|MgX|2}}

:{{chem|R|2|Cd}} + 2R'COCl → 2R'COR + {{chem|CdCl|2}}

Such reagents have largely been supplanted by organocopper compounds, which are much less toxic.

Cadmium chloride is also used for photocopying, dyeing and electroplating.

It was used in the first experience for detecting neutrinos, the Cowan–Reines neutrino experiment.

Like all cadmium compounds, {{chem|CdCl|2}} is highly toxic and appropriate safety precautions must be taken when handling it.

References

{{reflist}}