Barium bis[1-(but-3-en-1-yl)-2,3,4,5-tetramethylcyclopenta-2,4-dien-1-ide]
Basic information
- CAS
835653-25-3- Standard SMILES
C=CCCc1c(C)c(C)[c-](C)c1C.C=CCCc1c(C)c(C)[c-](C)c1C.[Ba+2]- InChIKey
SPKSPFITRQFOOK-UHFFFAOYSA-N- Molecular formula
- C26H38Ba
- Average molar mass
- 487.9 g/mol
- Monoisotopic mass
- 488.202598
Names & identifiers
- Preferred name
- Barium bis[1-(but-3-en-1-yl)-2,3,4,5-tetramethylcyclopenta-2,4-dien-1-ide]
- IUPAC
- barium(2+);bis(2-but-3-enyl-1,3,4,5-tetramethylcyclopenta-1,3-diene)
Names & synonyms
835653-25-3DTXSID00834423Barium bis[1-(but-3-en-1-yl)-2,3,4,5-tetramethylcyclopenta-2,4-dien-1-ide]
Database identifiers
- CAS
835653-25-3- PubChem CID
- 78067652
- DTXSID
DTXSID00834423
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 157
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Related reactions
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Compound notes
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