dichloronickel;nickel(2+);disulfamate

H4Cl2N2Ni2O6S2 — CID 161475993

IUPACdichloronickel;nickel(2+);disulfamate
SMILESCl[Ni]Cl.NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Ni+2]
InChIInChI=1S/2ClH.2H3NO3S.2Ni/c;;2*1-5(2,3)4;;/h2*1H;2*(H3,1,2,3,4);;/q;;;;2*+2/p-4
InChIKeyWDSKYXKWMOQUKU-UHFFFAOYSA-J
MW380.47 g/mol
LogP-1.82
Rot. Bonds

About dichloronickel;nickel(2+);disulfamate

dichloronickel;nickel(2+);disulfamate (PubChem CID 161475993) has the molecular formula H4Cl2N2Ni2O6S2 and a molecular weight of 380.47 g/mol. Its IUPAC name is dichloronickel;nickel(2+);disulfamate.

Molecular Properties

Compound Namedichloronickel;nickel(2+);disulfamate
PubChem CID161475993
Molecular FormulaH4Cl2N2Ni2O6S2
Molecular Weight380.47 g/mol
Exact Mass377.76
IUPAC Namedichloronickel;nickel(2+);disulfamate
SMILESCl[Ni]Cl.NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Ni+2]
InChIInChI=1S/2ClH.2H3NO3S.2Ni/c;;2*1-5(2,3)4;;/h2*1H;2*(H3,1,2,3,4);;/q;;;;2*+2/p-4
InChIKeyWDSKYXKWMOQUKU-UHFFFAOYSA-J
XLogP-1.82
TPSA166.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.47
LogP ≤ 5-1.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

nickel(2+);disulfamate;hexahydrate
CID 139665269
azanide;nickel(2+);sulfamate
CID 174833481
cobalt(2+);nickel(2+);tetrasulfamate
CID 160768956
silver;azane;sulfamate
CID 159760884
cobalt(2+) disulfamate
CID 26398
nickel(2+);cyanide;sulfamate
CID 160755995
indium(3+);lead(2+);pentasulfamate
CID 160881617
cobalt(2+);nickel;disulfamate
CID 173214745
sodium;azane;sulfamate;hydrochloride
CID 175097549
boric acid;dichloronickel;bis(nickel(2+));disulfate
CID 158265484
bis(nickel(2+));sulfamic acid;disulfate
CID 157251351
cobalt(2+);nickel(2+);sulfamic acid;disulfate
CID 174840417

Frequently Asked Questions

What is the IUPAC name of dichloronickel;nickel(2+);disulfamate?
The IUPAC name of dichloronickel;nickel(2+);disulfamate (CID 161475993) is dichloronickel;nickel(2+);disulfamate.
What is the SMILES notation for dichloronickel;nickel(2+);disulfamate?
The canonical SMILES for dichloronickel;nickel(2+);disulfamate is Cl[Ni]Cl.NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Ni+2].
What is the InChIKey of dichloronickel;nickel(2+);disulfamate?
The InChIKey is WDSKYXKWMOQUKU-UHFFFAOYSA-J. The full InChI is InChI=1S/2ClH.2H3NO3S.2Ni/c;;2*1-5(2,3)4;;/h2*1H;2*(H3,1,2,3,4);;/q;;;;2*+2/p-4.
What are the key properties of dichloronickel;nickel(2+);disulfamate?
dichloronickel;nickel(2+);disulfamate has a molecular weight of 380.47 g/mol, XLogP of -1.82, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dichloronickel;nickel(2+);disulfamate is sourced from PubChem (CID 161475993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).