bis(acetonitrile);copper(1+)

C4H6CuN2+ — CID 71446886

IUPACbis(acetonitrile);copper(1+)
SMILESCC#N.CC#N.[Cu+]
InChIInChI=1S/2C2H3N.Cu/c2*1-2-3;/h2*1H3;/q;;+1
InChIKeyBYDFLCUGTTXRKN-UHFFFAOYSA-N
MW145.65 g/mol
LogP1.06
Rot. Bonds

About bis(acetonitrile);copper(1+)

bis(acetonitrile);copper(1+) (PubChem CID 71446886) has the molecular formula C4H6CuN2+ and a molecular weight of 145.65 g/mol. Its IUPAC name is bis(acetonitrile);copper(1+).

Molecular Properties

Compound Namebis(acetonitrile);copper(1+)
PubChem CID71446886
Molecular FormulaC4H6CuN2+
Molecular Weight145.65 g/mol
Exact Mass144.98
IUPAC Namebis(acetonitrile);copper(1+)
SMILESCC#N.CC#N.[Cu+]
InChIInChI=1S/2C2H3N.Cu/c2*1-2-3;/h2*1H3;/q;;+1
InChIKeyBYDFLCUGTTXRKN-UHFFFAOYSA-N
XLogP1.06
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.65
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of bis(acetonitrile);copper(1+)?
The IUPAC name of bis(acetonitrile);copper(1+) (CID 71446886) is bis(acetonitrile);copper(1+).
What is the SMILES notation for bis(acetonitrile);copper(1+)?
The canonical SMILES for bis(acetonitrile);copper(1+) is CC#N.CC#N.[Cu+].
What is the InChIKey of bis(acetonitrile);copper(1+)?
The InChIKey is BYDFLCUGTTXRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H3N.Cu/c2*1-2-3;/h2*1H3;/q;;+1.
What are the key properties of bis(acetonitrile);copper(1+)?
bis(acetonitrile);copper(1+) has a molecular weight of 145.65 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(acetonitrile);copper(1+) is sourced from PubChem (CID 71446886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).