nickel(2+) hexacyanide

C6N6Ni-4 — CID 51346380

IUPACnickel(2+) hexacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ni+2]
InChIInChI=1S/6CN.Ni/c6*1-2;/q6*-1;+2
InChIKeyUJTXFLILHPBDPD-UHFFFAOYSA-N
MW214.80 g/mol
LogP0.58
Rot. Bonds

About nickel(2+) hexacyanide

nickel(2+) hexacyanide (PubChem CID 51346380) has the molecular formula C6N6Ni-4 and a molecular weight of 214.80 g/mol. Its IUPAC name is nickel(2+) hexacyanide.

Molecular Properties

Compound Namenickel(2+) hexacyanide
PubChem CID51346380
Molecular FormulaC6N6Ni-4
Molecular Weight214.80 g/mol
Exact Mass213.96
IUPAC Namenickel(2+) hexacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ni+2]
InChIInChI=1S/6CN.Ni/c6*1-2;/q6*-1;+2
InChIKeyUJTXFLILHPBDPD-UHFFFAOYSA-N
XLogP0.58
TPSA142.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.80
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

azane;nickel(2+);dicyanide
CID 160876197
nickel;nickel(2+);dicyanide
CID 88833591
tetrasodium;iron(3+);hexacyanide;hydroxide
CID 173042074
chromium(3+);molybdenum;nickel(2+);undecacyanide
CID 173413335
silane cyanide
CID 161121622
cyanide hydrate
CID 71367363
dipotassium;tetracyanide
CID 172816022
chromium(3+) tricyanide
CID 14818425
chromium cyanide
CID 172741704
palladium(2+) tetracyanide
CID 12049713
zinc bis((15N)azanylidyne(113C)methane)
CID 71309451
thallium(1+) cyanide
CID 22251319

Frequently Asked Questions

What is the IUPAC name of nickel(2+) hexacyanide?
The IUPAC name of nickel(2+) hexacyanide (CID 51346380) is nickel(2+) hexacyanide.
What is the SMILES notation for nickel(2+) hexacyanide?
The canonical SMILES for nickel(2+) hexacyanide is [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ni+2].
What is the InChIKey of nickel(2+) hexacyanide?
The InChIKey is UJTXFLILHPBDPD-UHFFFAOYSA-N. The full InChI is InChI=1S/6CN.Ni/c6*1-2;/q6*-1;+2.
What are the key properties of nickel(2+) hexacyanide?
nickel(2+) hexacyanide has a molecular weight of 214.80 g/mol, XLogP of 0.58, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for nickel(2+) hexacyanide is sourced from PubChem (CID 51346380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).