neodymium;oxalic acid;uranium

C2H2Nd2O4U2 — CID 118451835

IUPACneodymium;oxalic acid;uranium
SMILESO=C(O)C(=O)O.[Nd].[Nd].[U].[U]
InChIInChI=1S/C2H2O4.2Nd.2U/c3-1(4)2(5)6;;;;/h(H,3,4)(H,5,6);;;;
InChIKeyZUINGMHOAUPLKQ-UHFFFAOYSA-N
MW854.57 g/mol
LogP-0.84
Rot. Bonds

About neodymium;oxalic acid;uranium

neodymium;oxalic acid;uranium (PubChem CID 118451835) has the molecular formula C2H2Nd2O4U2 and a molecular weight of 854.57 g/mol. Its IUPAC name is neodymium;oxalic acid;uranium.

Molecular Properties

Compound Nameneodymium;oxalic acid;uranium
PubChem CID118451835
Molecular FormulaC2H2Nd2O4U2
Molecular Weight854.57 g/mol
Exact Mass849.91
IUPAC Nameneodymium;oxalic acid;uranium
SMILESO=C(O)C(=O)O.[Nd].[Nd].[U].[U]
InChIInChI=1S/C2H2O4.2Nd.2U/c3-1(4)2(5)6;;;;/h(H,3,4)(H,5,6);;;;
InChIKeyZUINGMHOAUPLKQ-UHFFFAOYSA-N
XLogP-0.84
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500854.57
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

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CID 170845858
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CID 91886498
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Frequently Asked Questions

What is the IUPAC name of neodymium;oxalic acid;uranium?
The IUPAC name of neodymium;oxalic acid;uranium (CID 118451835) is neodymium;oxalic acid;uranium.
What is the SMILES notation for neodymium;oxalic acid;uranium?
The canonical SMILES for neodymium;oxalic acid;uranium is O=C(O)C(=O)O.[Nd].[Nd].[U].[U].
What is the InChIKey of neodymium;oxalic acid;uranium?
The InChIKey is ZUINGMHOAUPLKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2O4.2Nd.2U/c3-1(4)2(5)6;;;;/h(H,3,4)(H,5,6);;;;.
What are the key properties of neodymium;oxalic acid;uranium?
neodymium;oxalic acid;uranium has a molecular weight of 854.57 g/mol, XLogP of -0.84, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for neodymium;oxalic acid;uranium is sourced from PubChem (CID 118451835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).