calcium;samarium;difluoride

CaF2Sm — CID 174866336

IUPACcalcium;samarium;difluoride
SMILES[Ca+2].[F-].[F-].[Sm]
InChIInChI=1S/Ca.2FH.Sm/h;2*1H;/q+2;;;/p-2
InChIKeyDTIUNRYLRAIDAX-UHFFFAOYSA-L
MW228.43 g/mol
LogP-6.37
Rot. Bonds

About calcium;samarium;difluoride

calcium;samarium;difluoride (PubChem CID 174866336) has the molecular formula CaF2Sm and a molecular weight of 228.43 g/mol. Its IUPAC name is calcium;samarium;difluoride.

Molecular Properties

Compound Namecalcium;samarium;difluoride
PubChem CID174866336
Molecular FormulaCaF2Sm
Molecular Weight228.43 g/mol
Exact Mass229.88
IUPAC Namecalcium;samarium;difluoride
SMILES[Ca+2].[F-].[F-].[Sm]
InChIInChI=1S/Ca.2FH.Sm/h;2*1H;/q+2;;;/p-2
InChIKeyDTIUNRYLRAIDAX-UHFFFAOYSA-L
XLogP-6.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.43
LogP ≤ 5-6.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of calcium;samarium;difluoride?
The IUPAC name of calcium;samarium;difluoride (CID 174866336) is calcium;samarium;difluoride.
What is the SMILES notation for calcium;samarium;difluoride?
The canonical SMILES for calcium;samarium;difluoride is [Ca+2].[F-].[F-].[Sm].
What is the InChIKey of calcium;samarium;difluoride?
The InChIKey is DTIUNRYLRAIDAX-UHFFFAOYSA-L. The full InChI is InChI=1S/Ca.2FH.Sm/h;2*1H;/q+2;;;/p-2.
What are the key properties of calcium;samarium;difluoride?
calcium;samarium;difluoride has a molecular weight of 228.43 g/mol, XLogP of -6.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;samarium;difluoride is sourced from PubChem (CID 174866336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).