ethane;formylazanide;tantalum(2+)

C3H7NOTa — CID 57465798

IUPACethane;formylazanide;tantalum(2+)
SMILES[CH2-]C.[NH-]C=O.[Ta+2]
InChIInChI=1S/C2H5.CH3NO.Ta/c1-2;2-1-3;/h1H2,2H3;1H,(H2,2,3);/q-1;;+2/p-1
InChIKeyKYZAADANGRHGIU-UHFFFAOYSA-M
MW254.04 g/mol
LogP1.03
Rot. Bonds

About ethane;formylazanide;tantalum(2+)

ethane;formylazanide;tantalum(2+) (PubChem CID 57465798) has the molecular formula C3H7NOTa and a molecular weight of 254.04 g/mol. Its IUPAC name is ethane;formylazanide;tantalum(2+).

Molecular Properties

Compound Nameethane;formylazanide;tantalum(2+)
PubChem CID57465798
Molecular FormulaC3H7NOTa
Molecular Weight254.04 g/mol
Exact Mass254.00
IUPAC Nameethane;formylazanide;tantalum(2+)
SMILES[CH2-]C.[NH-]C=O.[Ta+2]
InChIInChI=1S/C2H5.CH3NO.Ta/c1-2;2-1-3;/h1H2,2H3;1H,(H2,2,3);/q-1;;+2/p-1
InChIKeyKYZAADANGRHGIU-UHFFFAOYSA-M
XLogP1.03
TPSA40.87 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.04
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

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dioxohafnium;ethane
CID 18944780
acetaldehyde;azane
CID 158638397
acetaldehyde;stibane
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acetaldehyde;bismuthane
CID 173068240
acetaldehyde;gold
CID 173056569
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Frequently Asked Questions

What is the IUPAC name of ethane;formylazanide;tantalum(2+)?
The IUPAC name of ethane;formylazanide;tantalum(2+) (CID 57465798) is ethane;formylazanide;tantalum(2+).
What is the SMILES notation for ethane;formylazanide;tantalum(2+)?
The canonical SMILES for ethane;formylazanide;tantalum(2+) is [CH2-]C.[NH-]C=O.[Ta+2].
What is the InChIKey of ethane;formylazanide;tantalum(2+)?
The InChIKey is KYZAADANGRHGIU-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H5.CH3NO.Ta/c1-2;2-1-3;/h1H2,2H3;1H,(H2,2,3);/q-1;;+2/p-1.
What are the key properties of ethane;formylazanide;tantalum(2+)?
ethane;formylazanide;tantalum(2+) has a molecular weight of 254.04 g/mol, XLogP of 1.03, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;formylazanide;tantalum(2+) is sourced from PubChem (CID 57465798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).