cerium(4+);1H-imidazole

C3H4CeN2+4 — CID 175891649

IUPACcerium(4+);1H-imidazole
SMILES[Ce+4].c1c[nH]cn1
InChIInChI=1S/C3H4N2.Ce/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+4
InChIKeyGZDPTDPCGBPXRY-UHFFFAOYSA-N
MW208.20 g/mol
LogP0.41
Rot. Bonds

About cerium(4+);1H-imidazole

cerium(4+);1H-imidazole (PubChem CID 175891649) has the molecular formula C3H4CeN2+4 and a molecular weight of 208.20 g/mol. Its IUPAC name is cerium(4+);1H-imidazole.

Molecular Properties

Compound Namecerium(4+);1H-imidazole
PubChem CID175891649
Molecular FormulaC3H4CeN2+4
Molecular Weight208.20 g/mol
Exact Mass207.94
IUPAC Namecerium(4+);1H-imidazole
SMILES[Ce+4].c1c[nH]cn1
InChIInChI=1S/C3H4N2.Ce/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+4
InChIKeyGZDPTDPCGBPXRY-UHFFFAOYSA-N
XLogP0.41
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.20
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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chloranium 1H-imidazole
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1H-imidazole;nickel(2+);dichloride
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1H-imidazole;ruthenium(2+)
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bis(1H-imidazole);dihydrochloride
CID 173058231
1H-imidazole;dihydrate
CID 67700139
potassium 1H-imidazole
CID 18415043
copper;1H-imidazole
CID 159630200
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CID 57451196
1H-imidazole;palladium;hydrate
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Frequently Asked Questions

What is the IUPAC name of cerium(4+);1H-imidazole?
The IUPAC name of cerium(4+);1H-imidazole (CID 175891649) is cerium(4+);1H-imidazole.
What is the SMILES notation for cerium(4+);1H-imidazole?
The canonical SMILES for cerium(4+);1H-imidazole is [Ce+4].c1c[nH]cn1.
What is the InChIKey of cerium(4+);1H-imidazole?
The InChIKey is GZDPTDPCGBPXRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.Ce/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+4.
What are the key properties of cerium(4+);1H-imidazole?
cerium(4+);1H-imidazole has a molecular weight of 208.20 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cerium(4+);1H-imidazole is sourced from PubChem (CID 175891649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).