Cerium(III) sulfate xhydrate

Catalog Number
ACM13550475-1
CAS
13550-47-5
IUPAC Name
Cerium(3+);trisulfate;hydrate
Synonyms
Cerium(III) sulfate N-hydrate
Molecular Weight
586.4
Molecular Formula
Ce2H2O13S3
Product Information
Canonical SMILES
O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ce+3].[Ce+3]
InChI
InChI=1S/2Ce.3H₂O4S.H₂O/c;3*1-5(2,3)4;/h;3*(H2,1,2,3,4);1H2/q2*+3;/p-6
InChI Key
KKVSNHQGJGJMHA-UHFFFAOYSA-H
Purity
99%+
Density
2.89 g/mL at 25 °C (lit.)
Appearance
Solid
Complexity
62.2
Covalently-Bonded Unit Count
6
Exact Mass
585.67665
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
13
Hydrogen Bond Donor Count
1
Monoisotopic Mass
585.67665
Rotatable Bond Count
0
Topological Polar Surface Area
267 Ų
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