triazanium;dichlorozinc;trichloride

H12Cl5N3Zn — CID 11551108

IUPACtriazanium;dichlorozinc;trichloride
SMILESCl[Zn]Cl.[Cl-].[Cl-].[Cl-].[NH4+].[NH4+].[NH4+]
InChIInChI=1S/5ClH.3H3N.Zn/h5*1H;3*1H3;/q;;;;;;;;+2/p-2
InChIKeyIYBCULKOHOEVED-UHFFFAOYSA-L
MW296.77 g/mol
LogP-6.48
Rot. Bonds

About triazanium;dichlorozinc;trichloride

triazanium;dichlorozinc;trichloride (PubChem CID 11551108) has the molecular formula H12Cl5N3Zn and a molecular weight of 296.77 g/mol. Its IUPAC name is triazanium;dichlorozinc;trichloride.

Molecular Properties

Compound Nametriazanium;dichlorozinc;trichloride
PubChem CID11551108
Molecular FormulaH12Cl5N3Zn
Molecular Weight296.77 g/mol
Exact Mass292.88
IUPAC Nametriazanium;dichlorozinc;trichloride
SMILESCl[Zn]Cl.[Cl-].[Cl-].[Cl-].[NH4+].[NH4+].[NH4+]
InChIInChI=1S/5ClH.3H3N.Zn/h5*1H;3*1H3;/q;;;;;;;;+2/p-2
InChIKeyIYBCULKOHOEVED-UHFFFAOYSA-L
XLogP-6.48
TPSA109.50 Ų
H-Bond Donors3
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.77
LogP ≤ 5-6.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triazanium;dichlorozinc;trichloride?
The IUPAC name of triazanium;dichlorozinc;trichloride (CID 11551108) is triazanium;dichlorozinc;trichloride.
What is the SMILES notation for triazanium;dichlorozinc;trichloride?
The canonical SMILES for triazanium;dichlorozinc;trichloride is Cl[Zn]Cl.[Cl-].[Cl-].[Cl-].[NH4+].[NH4+].[NH4+].
What is the InChIKey of triazanium;dichlorozinc;trichloride?
The InChIKey is IYBCULKOHOEVED-UHFFFAOYSA-L. The full InChI is InChI=1S/5ClH.3H3N.Zn/h5*1H;3*1H3;/q;;;;;;;;+2/p-2.
What are the key properties of triazanium;dichlorozinc;trichloride?
triazanium;dichlorozinc;trichloride has a molecular weight of 296.77 g/mol, XLogP of -6.48, 0 rotatable bonds, 3 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triazanium;dichlorozinc;trichloride is sourced from PubChem (CID 11551108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).