calcium;azane;dihydroxy(oxo)silane;hydride

H7CaNO3Si — CID 173047701

IUPACcalcium;azane;dihydroxy(oxo)silane;hydride
SMILESN.O=[Si](O)O.[Ca+2].[H-].[H-]
InChIInChI=1S/Ca.H3N.H2O3Si.2H/c;;1-4(2)3;;/h;1H3;1-2H;;/q+2;;;2*-1
InChIKeyIQRIIIGBYQRLOB-UHFFFAOYSA-N
MW137.22 g/mol
LogP-1.61
Rot. Bonds

About calcium;azane;dihydroxy(oxo)silane;hydride

calcium;azane;dihydroxy(oxo)silane;hydride (PubChem CID 173047701) has the molecular formula H7CaNO3Si and a molecular weight of 137.22 g/mol. Its IUPAC name is calcium;azane;dihydroxy(oxo)silane;hydride.

Molecular Properties

Compound Namecalcium;azane;dihydroxy(oxo)silane;hydride
PubChem CID173047701
Molecular FormulaH7CaNO3Si
Molecular Weight137.22 g/mol
Exact Mass136.98
IUPAC Namecalcium;azane;dihydroxy(oxo)silane;hydride
SMILESN.O=[Si](O)O.[Ca+2].[H-].[H-]
InChIInChI=1S/Ca.H3N.H2O3Si.2H/c;;1-4(2)3;;/h;1H3;1-2H;;/q+2;;;2*-1
InChIKeyIQRIIIGBYQRLOB-UHFFFAOYSA-N
XLogP-1.61
TPSA92.53 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.22
LogP ≤ 5-1.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

calcium;strontium;dihydroxy(oxo)silane;hydride
CID 173249144
calcium;magnesium;dihydroxy(oxo)silane;hydride
CID 172995429
calcium;dihydroxy(oxo)silane;hydride;λ2-stannane
CID 173457628
calcium;lithium;bis(dihydroxy(oxo)silane);hydride
CID 173292536
azane;tris(dihydroxy(oxo)silane)
CID 173008819
calcium;sodium;alumane;dihydroxy(oxo)silane;hydride
CID 173002492
calcium;magnesium;strontium;dihydroxy(oxo)silane;hydride
CID 173037224
tripotassium;tris(dihydroxy(oxo)silane);hydride
CID 173424643
disodium;nonakis(dihydroxy(oxo)silane);hydride
CID 173280804
hexalithium;decakis(dihydroxy(oxo)silane);hydride
CID 173441514
azane;dihydroxy(oxo)silane;hydrate
CID 173119043
pentasodium;pentakis(dihydroxy(oxo)silane);hydride
CID 173144573

Frequently Asked Questions

What is the IUPAC name of calcium;azane;dihydroxy(oxo)silane;hydride?
The IUPAC name of calcium;azane;dihydroxy(oxo)silane;hydride (CID 173047701) is calcium;azane;dihydroxy(oxo)silane;hydride.
What is the SMILES notation for calcium;azane;dihydroxy(oxo)silane;hydride?
The canonical SMILES for calcium;azane;dihydroxy(oxo)silane;hydride is N.O=[Si](O)O.[Ca+2].[H-].[H-].
What is the InChIKey of calcium;azane;dihydroxy(oxo)silane;hydride?
The InChIKey is IQRIIIGBYQRLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.H3N.H2O3Si.2H/c;;1-4(2)3;;/h;1H3;1-2H;;/q+2;;;2*-1.
What are the key properties of calcium;azane;dihydroxy(oxo)silane;hydride?
calcium;azane;dihydroxy(oxo)silane;hydride has a molecular weight of 137.22 g/mol, XLogP of -1.61, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;azane;dihydroxy(oxo)silane;hydride is sourced from PubChem (CID 173047701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).