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Bis(2,6-diaminopyridine)tetra(μ-O,O'-trimethylacetato)dicopper(II)

Catalog Number ACM1135444608
CAS 1135444-60-8
Synonyms Dicopper;2,2-dimethylpropanoate;pyridine-2,6-diamine
Molecular Weight 749.8
Molecular Formula C30H50Cu2N6O8
Canonical SMILES CC(C)(C)C(=O)[O-].CC(C)(C)C(=O)[O-].CC(C)(C)C(=O)[O-].CC(C)(C)C(=O)[O-].C1=CC(=NC(=C1)N)N.C1=CC(=NC(=C1)N)N.[Cu+2].[Cu+2]
InChI InChI=1S/2C5H7N3.4C5H10O2.2Cu/c2*6-4-2-1-3-5(7)8-4;4*1-5(2,3)4(6)7;/h2*1-3H,(H4,6,7,8);4*1-3H3,(H,6,7);/q;2*+2/p-4
InChI Key IEVNNCLBTWOMHI-UHFFFAOYSA-J
Purity 98%
Complexity 685
Covalently-Bonded Unit Count 8
Defined Atom Stereocenter Count 0
Exact Mass 748.228207
Heavy Atom Count 46
Hydrogen Bond Acceptor Count 14
Hydrogen Bond Donor Count 4
Monoisotopic Mass 748.228207
Rotatable Bond Count 4
Topological Polar Surface Area 290 Ų

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