neodymium(3+) trinitrite

N3NdO6 — CID 158721016

IUPACneodymium(3+) trinitrite
SMILESO=N[O-].O=N[O-].O=N[O-].[Nd+3]
InChIInChI=1S/3HNO2.Nd/c3*2-1-3;/h3*(H,2,3);/q;;;+3/p-3
InChIKeyIJXKECNPVXYMRX-UHFFFAOYSA-K
MW282.25 g/mol
LogP0.75
Rot. Bonds

About neodymium(3+) trinitrite

neodymium(3+) trinitrite (PubChem CID 158721016) has the molecular formula N3NdO6 and a molecular weight of 282.25 g/mol. Its IUPAC name is neodymium(3+) trinitrite.

Molecular Properties

Compound Nameneodymium(3+) trinitrite
PubChem CID158721016
Molecular FormulaN3NdO6
Molecular Weight282.25 g/mol
Exact Mass279.89
IUPAC Nameneodymium(3+) trinitrite
SMILESO=N[O-].O=N[O-].O=N[O-].[Nd+3]
InChIInChI=1S/3HNO2.Nd/c3*2-1-3;/h3*(H,2,3);/q;;;+3/p-3
InChIKeyIJXKECNPVXYMRX-UHFFFAOYSA-K
XLogP0.75
TPSA157.47 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.25
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 20831815
Sodium nitrite N-15
CID 23662135
thorium nitrite
CID 154069841
lead(2+) nitrite
CID 23623754
lithium nitrite
CID 23673709
CID 20981982
CID 20981982
CID 19007947
CID 19007947
silver nitrite
CID 25199704
praseodymium(3+) trinitrite
CID 161020304
platinum(2+) dinitrite
CID 173066293
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CID 22721316
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CID 22757713

Frequently Asked Questions

What is the IUPAC name of neodymium(3+) trinitrite?
The IUPAC name of neodymium(3+) trinitrite (CID 158721016) is neodymium(3+) trinitrite.
What is the SMILES notation for neodymium(3+) trinitrite?
The canonical SMILES for neodymium(3+) trinitrite is O=N[O-].O=N[O-].O=N[O-].[Nd+3].
What is the InChIKey of neodymium(3+) trinitrite?
The InChIKey is IJXKECNPVXYMRX-UHFFFAOYSA-K. The full InChI is InChI=1S/3HNO2.Nd/c3*2-1-3;/h3*(H,2,3);/q;;;+3/p-3.
What are the key properties of neodymium(3+) trinitrite?
neodymium(3+) trinitrite has a molecular weight of 282.25 g/mol, XLogP of 0.75, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for neodymium(3+) trinitrite is sourced from PubChem (CID 158721016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).