calcium;alumane;hydride;manganese;sulfuric acid

H7AlCaMnO4S — CID 173203697

IUPACcalcium;alumane;hydride;manganese;sulfuric acid
SMILESO=S(=O)(O)O.[AlH3].[Ca+2].[H-].[H-].[Mn]
InChIInChI=1S/Al.Ca.Mn.H2O4S.5H/c;;;1-5(2,3)4;;;;;/h;;;(H2,1,2,3,4);;;;;/q;+2;;;;;;2*-1
InChIKeySHIMFYXKFMMCIF-UHFFFAOYSA-N
MW225.12 g/mol
LogP-2.00
Rot. Bonds

About calcium;alumane;hydride;manganese;sulfuric acid

calcium;alumane;hydride;manganese;sulfuric acid (PubChem CID 173203697) has the molecular formula H7AlCaMnO4S and a molecular weight of 225.12 g/mol. Its IUPAC name is calcium;alumane;hydride;manganese;sulfuric acid.

Molecular Properties

Compound Namecalcium;alumane;hydride;manganese;sulfuric acid
PubChem CID173203697
Molecular FormulaH7AlCaMnO4S
Molecular Weight225.12 g/mol
Exact Mass224.89
IUPAC Namecalcium;alumane;hydride;manganese;sulfuric acid
SMILESO=S(=O)(O)O.[AlH3].[Ca+2].[H-].[H-].[Mn]
InChIInChI=1S/Al.Ca.Mn.H2O4S.5H/c;;;1-5(2,3)4;;;;;/h;;;(H2,1,2,3,4);;;;;/q;+2;;;;;;2*-1
InChIKeySHIMFYXKFMMCIF-UHFFFAOYSA-N
XLogP-2.00
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.12
LogP ≤ 5-2.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 175130797
calcium;alumane;hydrazine;hydride;sulfuric acid
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dicalcium;hydride;sulfuric acid;dihydrate
CID 173090602
dicalcium;hydride;sulfuric acid;pentahydrate
CID 173205930
calcium;hydride;sulfuric acid;hydrochloride
CID 173159750
dicalcium;hydride;sulfuric acid;hydrochloride
CID 173127277
dicalcium;hydride;sulfuric acid;hydrate
CID 173153468
sulfuric acid;ytterbium
CID 156591912
alumane;sulfuric acid
CID 173042837
calcium;barium(2+);hydride;sulfuric acid;zinc
CID 174925769
calcium;hydride;iron;sulfuric acid;hydrochloride
CID 173427945
alumane;hydride;rubidium(1+);sulfuric acid;dodecahydrate
CID 174704818

Frequently Asked Questions

What is the IUPAC name of calcium;alumane;hydride;manganese;sulfuric acid?
The IUPAC name of calcium;alumane;hydride;manganese;sulfuric acid (CID 173203697) is calcium;alumane;hydride;manganese;sulfuric acid.
What is the SMILES notation for calcium;alumane;hydride;manganese;sulfuric acid?
The canonical SMILES for calcium;alumane;hydride;manganese;sulfuric acid is O=S(=O)(O)O.[AlH3].[Ca+2].[H-].[H-].[Mn].
What is the InChIKey of calcium;alumane;hydride;manganese;sulfuric acid?
The InChIKey is SHIMFYXKFMMCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Ca.Mn.H2O4S.5H/c;;;1-5(2,3)4;;;;;/h;;;(H2,1,2,3,4);;;;;/q;+2;;;;;;2*-1.
What are the key properties of calcium;alumane;hydride;manganese;sulfuric acid?
calcium;alumane;hydride;manganese;sulfuric acid has a molecular weight of 225.12 g/mol, XLogP of -2.00, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;alumane;hydride;manganese;sulfuric acid is sourced from PubChem (CID 173203697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).