iron(2+);3-N-oxido-2-N-[2-[[(3E)-3-oxidoiminobutan-2-ylidene]amino]ethyl]butane-2,3-diimine
Basic information
- CAS
64047-27-4- Standard SMILES
CC(=NCCN=C(C)/C(C)=N/[O-])/C(C)=N\[O-].[Fe+2]- InChIKey
DKYQCZHMRKGINM-CSUJIYOBSA-L- Molecular formula
- C10H16FeN4O2
- Average molar mass
- 280.1 g/mol
- Monoisotopic mass
- 280.062261
Names & identifiers
- Preferred name
- iron(2+);3-N-oxido-2-N-[2-[[(3E)-3-oxidoiminobutan-2-ylidene]amino]ethyl]butane-2,3-diimine
- IUPAC
- iron(2+);3-N-oxido-2-N-[2-[[(3E)-3-oxidoiminobutan-2-ylidene]amino]ethyl]butane-2,3-diimine
Names & synonyms
64047-27-4
Database identifiers
- CAS
64047-27-4- PubChem CID
- 5486307
Properties
Computed structural properties
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 309
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Compound notes
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