cerium(3+) tricyanide

C3CeN3 — CID 161341874

IUPACcerium(3+) tricyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[Ce+3]
InChIInChI=1S/3CN.Ce/c3*1-2;/q3*-1;+3
InChIKeyVMTSRTBVAYBUFX-UHFFFAOYSA-N
MW218.17 g/mol
LogP0.29
Rot. Bonds

About cerium(3+) tricyanide

cerium(3+) tricyanide (PubChem CID 161341874) has the molecular formula C3CeN3 and a molecular weight of 218.17 g/mol. Its IUPAC name is cerium(3+) tricyanide.

Molecular Properties

Compound Namecerium(3+) tricyanide
PubChem CID161341874
Molecular FormulaC3CeN3
Molecular Weight218.17 g/mol
Exact Mass217.91
IUPAC Namecerium(3+) tricyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[Ce+3]
InChIInChI=1S/3CN.Ce/c3*1-2;/q3*-1;+3
InChIKeyVMTSRTBVAYBUFX-UHFFFAOYSA-N
XLogP0.29
TPSA71.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.17
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

chromium cyanide
CID 172741704
palladium(2+) tetracyanide
CID 12049713
chromium(3+) tricyanide
CID 14818425
zinc bis((15N)azanylidyne(113C)methane)
CID 71309451
cyanide hydrate
CID 71367363
dipotassium;tetracyanide
CID 172816022
thallium(1+) cyanide
CID 22251319
iridium tricyanide
CID 148548482
cadmium(2+) tetracyanide
CID 23278875
sodium cyanide
CID 8929
nickel(2+) hexacyanide
CID 51346380
silane cyanide
CID 161121622

Frequently Asked Questions

What is the IUPAC name of cerium(3+) tricyanide?
The IUPAC name of cerium(3+) tricyanide (CID 161341874) is cerium(3+) tricyanide.
What is the SMILES notation for cerium(3+) tricyanide?
The canonical SMILES for cerium(3+) tricyanide is [C-]#N.[C-]#N.[C-]#N.[Ce+3].
What is the InChIKey of cerium(3+) tricyanide?
The InChIKey is VMTSRTBVAYBUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/3CN.Ce/c3*1-2;/q3*-1;+3.
What are the key properties of cerium(3+) tricyanide?
cerium(3+) tricyanide has a molecular weight of 218.17 g/mol, XLogP of 0.29, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cerium(3+) tricyanide is sourced from PubChem (CID 161341874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).