bis(diethylazanide);neodymium;hydroiodide

C8H21IN2Nd-2 — CID 87163489

IUPACbis(diethylazanide);neodymium;hydroiodide
SMILESCC[N-]CC.CC[N-]CC.I.[Nd]
InChIInChI=1S/2C4H10N.HI.Nd/c2*1-3-5-4-2;;/h2*3-4H2,1-2H3;1H;/q2*-1;;
InChIKeyZNMIACKVBOQUMU-UHFFFAOYSA-N
MW416.41 g/mol
LogP3.42
Rot. Bonds4

About bis(diethylazanide);neodymium;hydroiodide

bis(diethylazanide);neodymium;hydroiodide (PubChem CID 87163489) has the molecular formula C8H21IN2Nd-2 and a molecular weight of 416.41 g/mol. Its IUPAC name is bis(diethylazanide);neodymium;hydroiodide.

Molecular Properties

Compound Namebis(diethylazanide);neodymium;hydroiodide
PubChem CID87163489
Molecular FormulaC8H21IN2Nd-2
Molecular Weight416.41 g/mol
Exact Mass413.98
IUPAC Namebis(diethylazanide);neodymium;hydroiodide
SMILESCC[N-]CC.CC[N-]CC.I.[Nd]
InChIInChI=1S/2C4H10N.HI.Nd/c2*1-3-5-4-2;;/h2*3-4H2,1-2H3;1H;/q2*-1;;
InChIKeyZNMIACKVBOQUMU-UHFFFAOYSA-N
XLogP3.42
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.41
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(diethylazanide);neodymium;hydroiodide?
The IUPAC name of bis(diethylazanide);neodymium;hydroiodide (CID 87163489) is bis(diethylazanide);neodymium;hydroiodide.
What is the SMILES notation for bis(diethylazanide);neodymium;hydroiodide?
The canonical SMILES for bis(diethylazanide);neodymium;hydroiodide is CC[N-]CC.CC[N-]CC.I.[Nd].
What is the InChIKey of bis(diethylazanide);neodymium;hydroiodide?
The InChIKey is ZNMIACKVBOQUMU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H10N.HI.Nd/c2*1-3-5-4-2;;/h2*3-4H2,1-2H3;1H;/q2*-1;;.
What are the key properties of bis(diethylazanide);neodymium;hydroiodide?
bis(diethylazanide);neodymium;hydroiodide has a molecular weight of 416.41 g/mol, XLogP of 3.42, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(diethylazanide);neodymium;hydroiodide is sourced from PubChem (CID 87163489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).