bromonickel;carbanide

C3H9BrNi-3 — CID 151580117

IUPACbromonickel;carbanide
SMILES[CH3-].[CH3-].[CH3-].[Ni]Br
InChIInChI=1S/3CH3.BrH.Ni/h3*1H3;1H;/q3*-1;;+1/p-1
InChIKeyFHKZQQCTIZWUGF-UHFFFAOYSA-M
MW183.70 g/mol
LogP2.19
Rot. Bonds

About bromonickel;carbanide

bromonickel;carbanide (PubChem CID 151580117) has the molecular formula C3H9BrNi-3 and a molecular weight of 183.70 g/mol. Its IUPAC name is bromonickel;carbanide.

Molecular Properties

Compound Namebromonickel;carbanide
PubChem CID151580117
Molecular FormulaC3H9BrNi-3
Molecular Weight183.70 g/mol
Exact Mass181.93
IUPAC Namebromonickel;carbanide
SMILES[CH3-].[CH3-].[CH3-].[Ni]Br
InChIInChI=1S/3CH3.BrH.Ni/h3*1H3;1H;/q3*-1;;+1/p-1
InChIKeyFHKZQQCTIZWUGF-UHFFFAOYSA-M
XLogP2.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.70
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromonickel;carbanide?
The IUPAC name of bromonickel;carbanide (CID 151580117) is bromonickel;carbanide.
What is the SMILES notation for bromonickel;carbanide?
The canonical SMILES for bromonickel;carbanide is [CH3-].[CH3-].[CH3-].[Ni]Br.
What is the InChIKey of bromonickel;carbanide?
The InChIKey is FHKZQQCTIZWUGF-UHFFFAOYSA-M. The full InChI is InChI=1S/3CH3.BrH.Ni/h3*1H3;1H;/q3*-1;;+1/p-1.
What are the key properties of bromonickel;carbanide?
bromonickel;carbanide has a molecular weight of 183.70 g/mol, XLogP of 2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromonickel;carbanide is sourced from PubChem (CID 151580117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).