Bis(2-heptadecyl-1H-imidazole-N3)bis(octanoato-O)nickel
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Basic information
- CAS
68912-08-3- Standard SMILES
CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCc1ncc[nH]1.CCCCCCCCCCCCCCCCCc1ncc[nH]1.[Ni+2]- InChIKey
RMZZCMFBFAGGJS-UHFFFAOYSA-L- Molecular formula
- C56H106N4NiO4
- Average molar mass
- 958.2 g/mol
- Monoisotopic mass
- 956.75675
Names & identifiers
- Preferred name
- Bis(2-heptadecyl-1H-imidazole-N3)bis(octanoato-O)nickel
- IUPAC
- bis(2-heptadecyl-1H-imidazole);nickel(2+);bis(octanoate)
Names & synonyms
EINECS 272-799-6Nickel, bis(2-heptadecyl-1H-imidazole-kappaN3)bis(octanoato-kappaO)-Bis(2-heptadecyl-1H-imidazole-N3)bis(octanoato-O)nickelNickel, bis(2-heptadecyl-1H-imidazole-.kappa.N3)bis(octanoato-.kappa.O)-RefChem:568752272-799-6RVLDDFHQABRFCW-UHFFFAOYSA-L
Database identifiers
- CAS
68912-08-3- PubChem CID
- 173145
- EC Number
- 272-799-6
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 42
- Heavy atoms
- 65
- Formal charge
- 0
- Complexity
- 302
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Compound notes
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