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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
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You are here: Experimental > One molecule all properties |
Other names |
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Aluminum chloride; Aluminum chloride, dimer; dialuminum hexachloride; |
INChI | INChIKey | SMILES | IUPAC name |
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InChI=1S/2Al.4ClH.2Cl/h;;4*1H;;/q2*+2;;;;;;/p-4 | GHSXCATXXREJIA-UHFFFAOYSA-J | Cl[Al]1(Cl)Cl[Al](Cl)(Cl)Cl1 |
State | Conformation |
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1AG | D2H |
Property | Value | Uncertainty | units | Reference | Comment |
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Hfg(298.15K) ![]() |
-1295.74 | kJ mol-1 | webbook | ||
Hfg(0K) ![]() |
kJ mol-1 | webbook | |||
Entropy (298.15K) ![]() |
474.96 | J K-1 mol-1 | webbook |