oxoalumane;trifluoroneodymium

HAlF3NdO — CID 174865144

IUPACoxoalumane;trifluoroneodymium
SMILESF[Nd](F)F.O=[AlH]
InChIInChI=1S/Al.3FH.Nd.O.H/h;3*1H;;;/q;;;;+3;;/p-3
InChIKeyVXJNNSKTKUNVMJ-UHFFFAOYSA-K
MW245.22 g/mol
LogP0.49
Rot. Bonds

About oxoalumane;trifluoroneodymium

oxoalumane;trifluoroneodymium (PubChem CID 174865144) has the molecular formula HAlF3NdO and a molecular weight of 245.22 g/mol. Its IUPAC name is oxoalumane;trifluoroneodymium.

Molecular Properties

Compound Nameoxoalumane;trifluoroneodymium
PubChem CID174865144
Molecular FormulaHAlF3NdO
Molecular Weight245.22 g/mol
Exact Mass242.89
IUPAC Nameoxoalumane;trifluoroneodymium
SMILESF[Nd](F)F.O=[AlH]
InChIInChI=1S/Al.3FH.Nd.O.H/h;3*1H;;;/q;;;;+3;;/p-3
InChIKeyVXJNNSKTKUNVMJ-UHFFFAOYSA-K
XLogP0.49
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.22
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of oxoalumane;trifluoroneodymium?
The IUPAC name of oxoalumane;trifluoroneodymium (CID 174865144) is oxoalumane;trifluoroneodymium.
What is the SMILES notation for oxoalumane;trifluoroneodymium?
The canonical SMILES for oxoalumane;trifluoroneodymium is F[Nd](F)F.O=[AlH].
What is the InChIKey of oxoalumane;trifluoroneodymium?
The InChIKey is VXJNNSKTKUNVMJ-UHFFFAOYSA-K. The full InChI is InChI=1S/Al.3FH.Nd.O.H/h;3*1H;;;/q;;;;+3;;/p-3.
What are the key properties of oxoalumane;trifluoroneodymium?
oxoalumane;trifluoroneodymium has a molecular weight of 245.22 g/mol, XLogP of 0.49, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for oxoalumane;trifluoroneodymium is sourced from PubChem (CID 174865144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).