CAS
97586-18-0 Purity
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97586-18-0 Purity
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Specification
The molecular formula is CaCl2Cu3H2O3.
The molecular weight is 351.63 g/mol.
The IUPAC name is calcium;oxocopper;dihydrochloride.
The InChI is InChI=1S/Ca.2ClH.3Cu.3O/h;2*1H;;;;;;/q+2;;;;;;;;.
The InChIKey is SMEGKKGTUKDNCV-UHFFFAOYSA-N.
The canonical SMILES is O=[Cu].O=[Cu].O=[Cu].Cl.Cl.[Ca+2].
The CAS number is 97592-60-4.
The EC number is 307-257-0.
The hydrogen bond donor count is 2.
Yes, Calcium dichlorotrioxotricuprate(2-) is canonicalized.