barium(2+);dioxido(oxo)silane;lead(2+);sulfate

BaO7PbSSi — CID 173462630

IUPACbarium(2+);dioxido(oxo)silane;lead(2+);sulfate
SMILESO=S(=O)([O-])[O-].O=[Si]([O-])[O-].[Ba+2].[Pb+2]
InChIInChI=1S/Ba.H2O4S.O3Si.Pb/c;1-5(2,3)4;1-4(2)3;/h;(H2,1,2,3,4);;/q+2;;-2;+2/p-2
InChIKeyCMNJOKOOKQSQRH-UHFFFAOYSA-L
MW516.67 g/mol
LogP-4.98
Rot. Bonds

About barium(2+);dioxido(oxo)silane;lead(2+);sulfate

barium(2+);dioxido(oxo)silane;lead(2+);sulfate (PubChem CID 173462630) has the molecular formula BaO7PbSSi and a molecular weight of 516.67 g/mol. Its IUPAC name is barium(2+);dioxido(oxo)silane;lead(2+);sulfate.

Molecular Properties

Compound Namebarium(2+);dioxido(oxo)silane;lead(2+);sulfate
PubChem CID173462630
Molecular FormulaBaO7PbSSi
Molecular Weight516.67 g/mol
Exact Mass517.80
IUPAC Namebarium(2+);dioxido(oxo)silane;lead(2+);sulfate
SMILESO=S(=O)([O-])[O-].O=[Si]([O-])[O-].[Ba+2].[Pb+2]
InChIInChI=1S/Ba.H2O4S.O3Si.Pb/c;1-5(2,3)4;1-4(2)3;/h;(H2,1,2,3,4);;/q+2;;-2;+2/p-2
InChIKeyCMNJOKOOKQSQRH-UHFFFAOYSA-L
XLogP-4.98
TPSA143.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500516.67
LogP ≤ 5-4.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

dialuminum;dicalcium;disodium;tris(dioxido(oxo)silane);trisulfate
CID 18936011
dioxido(oxo)silane;lead(2+);phosphane
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lead(2+);stibane;sulfate
CID 175316158
octalithium;dioxido(oxo)silane;hexafluoride
CID 173056738
strontium;barium(2+);disulfate
CID 54725521
magnesium;lead(2+);disulfate
CID 159783766
azanide;bis(lead(2+));sulfate
CID 172999396
barium(2+);thorium(4+);trisulfate
CID 158644230
hexadecasilver;octasulfate
CID 174664647
lithium;disodium;dioxido(oxo)silane;hydroxide
CID 174832138
strontium;barium(2+);hydride;sulfate
CID 173209129
CID 22495127
CID 22495127

Frequently Asked Questions

What is the IUPAC name of barium(2+);dioxido(oxo)silane;lead(2+);sulfate?
The IUPAC name of barium(2+);dioxido(oxo)silane;lead(2+);sulfate (CID 173462630) is barium(2+);dioxido(oxo)silane;lead(2+);sulfate.
What is the SMILES notation for barium(2+);dioxido(oxo)silane;lead(2+);sulfate?
The canonical SMILES for barium(2+);dioxido(oxo)silane;lead(2+);sulfate is O=S(=O)([O-])[O-].O=[Si]([O-])[O-].[Ba+2].[Pb+2].
What is the InChIKey of barium(2+);dioxido(oxo)silane;lead(2+);sulfate?
The InChIKey is CMNJOKOOKQSQRH-UHFFFAOYSA-L. The full InChI is InChI=1S/Ba.H2O4S.O3Si.Pb/c;1-5(2,3)4;1-4(2)3;/h;(H2,1,2,3,4);;/q+2;;-2;+2/p-2.
What are the key properties of barium(2+);dioxido(oxo)silane;lead(2+);sulfate?
barium(2+);dioxido(oxo)silane;lead(2+);sulfate has a molecular weight of 516.67 g/mol, XLogP of -4.98, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);dioxido(oxo)silane;lead(2+);sulfate is sourced from PubChem (CID 173462630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).