About cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+)
cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) (PubChem CID 151334405) has the molecular formula C25H47F6HfN3Si
and a molecular weight of 710.24 g/mol. Its IUPAC name is cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+).
Molecular Properties
| Compound Name | cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) |
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| PubChem CID | 151334405 |
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| Molecular Formula | C25H47F6HfN3Si |
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| Molecular Weight | 710.24 g/mol |
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| Exact Mass | 711.29 |
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| IUPAC Name | cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) |
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| SMILES | CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.FC(F)(F)[SiH]([c-]1cccc1)C(F)(F)F.[Hf+4] |
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| InChI | InChI=1S/C7H5F6Si.3C6H14N.Hf/c8-6(9,10)14(7(11,12)13)5-3-1-2-4-5;3*1-5(2)7-6(3)4;/h1-4,14H;3*5-6H,1-4H3;/q4*-1;+4 |
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| InChIKey | OJCZBROCKCHOOH-UHFFFAOYSA-N |
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| XLogP | 8.57 |
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| TPSA | 42.30 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | 7 |
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| Heavy Atoms | 36 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 710.24 |
| LogP ≤ 5 | 8.57 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+)?
The IUPAC name of cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) (CID 151334405) is cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+).
What is the SMILES notation for cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+)?
The canonical SMILES for cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) is CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.FC(F)(F)[SiH]([c-]1cccc1)C(F)(F)F.[Hf+4].
What is the InChIKey of cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+)?
The InChIKey is OJCZBROCKCHOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F6Si.3C6H14N.Hf/c8-6(9,10)14(7(11,12)13)5-3-1-2-4-5;3*1-5(2)7-6(3)4;/h1-4,14H;3*5-6H,1-4H3;/q4*-1;+4.
What are the key properties of cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+)?
cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) has a molecular weight of 710.24 g/mol, XLogP of 8.57, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-2,4-dien-1-yl-bis(trifluoromethyl)silane;tris(di(propan-2-yl)azanide);hafnium(4+) is sourced from PubChem (CID 151334405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).