carbanide;copper;cyanide

C3H6CuN-3 — CID 87228917

IUPACcarbanide;copper;cyanide
SMILES[C-]#N.[CH3-].[CH3-].[Cu]
InChIInChI=1S/CN.2CH3.Cu/c1-2;;;/h;2*1H3;/q3*-1;
InChIKeyRNTFZTIXKRJVAM-UHFFFAOYSA-N
MW119.63 g/mol
LogP0.99
Rot. Bonds

About carbanide;copper;cyanide

carbanide;copper;cyanide (PubChem CID 87228917) has the molecular formula C3H6CuN-3 and a molecular weight of 119.63 g/mol. Its IUPAC name is carbanide;copper;cyanide.

Molecular Properties

Compound Namecarbanide;copper;cyanide
PubChem CID87228917
Molecular FormulaC3H6CuN-3
Molecular Weight119.63 g/mol
Exact Mass118.98
IUPAC Namecarbanide;copper;cyanide
SMILES[C-]#N.[CH3-].[CH3-].[Cu]
InChIInChI=1S/CN.2CH3.Cu/c1-2;;;/h;2*1H3;/q3*-1;
InChIKeyRNTFZTIXKRJVAM-UHFFFAOYSA-N
XLogP0.99
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.63
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 carbanide;copper;cyanide?
The IUPAC name of carbanide;copper;cyanide (CID 87228917) is carbanide;copper;cyanide.
What is the SMILES notation for carbanide;copper;cyanide?
The canonical SMILES for carbanide;copper;cyanide is [C-]#N.[CH3-].[CH3-].[Cu].
What is the InChIKey of carbanide;copper;cyanide?
The InChIKey is RNTFZTIXKRJVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/CN.2CH3.Cu/c1-2;;;/h;2*1H3;/q3*-1;.
What are the key properties of carbanide;copper;cyanide?
carbanide;copper;cyanide has a molecular weight of 119.63 g/mol, XLogP of 0.99, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;copper;cyanide is sourced from PubChem (CID 87228917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).