nickel(2+) carbonate

CNiO3 — CID 18746

IUPACnickel(2+) carbonate
SMILESO=C([O-])[O-].[Ni+2]
InChIInChI=1S/CH2O3.Ni/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2
InChIKeyZULUUIKRFGGGTL-UHFFFAOYSA-L
MW118.70 g/mol
LogP-2.45
Rot. Bonds

About nickel(2+) carbonate

nickel(2+) carbonate (PubChem CID 18746) has the molecular formula CNiO3 and a molecular weight of 118.70 g/mol. Its IUPAC name is nickel(2+) carbonate.

Molecular Properties

Compound Namenickel(2+) carbonate
PubChem CID18746
Molecular FormulaCNiO3
Molecular Weight118.70 g/mol
Exact Mass117.92
IUPAC Namenickel(2+) carbonate
SMILESO=C([O-])[O-].[Ni+2]
InChIInChI=1S/CH2O3.Ni/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2
InChIKeyZULUUIKRFGGGTL-UHFFFAOYSA-L
XLogP-2.45
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.70
LogP ≤ 5-2.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Carbon Dioxide
CID 280
Carbonate Ion
CID 19660
Hydron;carbonate
CID 22639876
((13)C)carbon dioxide
CID 10129882
Carbon dioxide-18O2
CID 12130228
Methane(~17~O_2_)dione
CID 12415844
Oxidooxomethyl
CID 6857677
Carbon-14C dioxide
CID 119388
Carbon trioxide
CID 520883
(111C)methanedione
CID 10197607
Carbon-13C dioxide-18O2, 99 atom % 13C, 95 atom % 18O
CID 24947461
Hydron carbonate
CID 22647601

Frequently Asked Questions

What is the IUPAC name of nickel(2+) carbonate?
The IUPAC name of nickel(2+) carbonate (CID 18746) is nickel(2+) carbonate.
What is the SMILES notation for nickel(2+) carbonate?
The canonical SMILES for nickel(2+) carbonate is O=C([O-])[O-].[Ni+2].
What is the InChIKey of nickel(2+) carbonate?
The InChIKey is ZULUUIKRFGGGTL-UHFFFAOYSA-L. The full InChI is InChI=1S/CH2O3.Ni/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2.
What are the key properties of nickel(2+) carbonate?
nickel(2+) carbonate has a molecular weight of 118.70 g/mol, XLogP of -2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for nickel(2+) carbonate is sourced from PubChem (CID 18746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).