Basic information
- CAS
69524-96-5- Standard SMILES
Cc1nn(-c2ccccc2)c(O)c1C(=O)c1ccccc1.Cc1nn(-c2ccccc2)c(O)c1C(=O)c1ccccc1.[Ni]- InChIKey
MDNLKSCFFIAIFV-UHFFFAOYSA-N- Molecular formula
- C34H28N4NiO4
- Average molar mass
- 615.3 g/mol
- Monoisotopic mass
- 614.146397
Names & identifiers
- Preferred name
- Bis(4-benzoyl-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-onato-O,O')nickel
- IUPAC
- bis((5-hydroxy-3-methyl-1-phenylpyrazol-4-yl)-phenylmethanone);nickel
Names & synonyms
EINECS 274-027-3Bis(4-benzoyl-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-onato-O,O')nickelRefChem:568881274-027-369524-96-5
Database identifiers
- CAS
69524-96-5- PubChem CID
- 136192513
- EC Number
- 274-027-3
Properties
Computed structural properties
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 800
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationRestricted substance: Bis(4-benzoyl-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-onato-O,O')nickel
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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