CID 173033903

Cu2Ga2In2S3 — CID 173033903

IUPAC—
SMILES[Cu].[Cu].[Ga+3].[Ga+3].[In].[In].[S-2].[S-2].[S-2]
InChIInChI=1S/2Cu.2Ga.2In.3S/q;;2*+3;;;3*-2
InChIKeyHISQFTORMKIXQW-UHFFFAOYSA-N
MW592.38 g/mol
LogP-1.54
Rot. Bonds

About CID 173033903

CID 173033903 (PubChem CID 173033903) has the molecular formula Cu2Ga2In2S3 and a molecular weight of 592.38 g/mol.

Molecular Properties

Compound NameCID 173033903
PubChem CID173033903
Molecular FormulaCu2Ga2In2S3
Molecular Weight592.38 g/mol
Exact Mass589.43
IUPAC Name—
SMILES[Cu].[Cu].[Ga+3].[Ga+3].[In].[In].[S-2].[S-2].[S-2]
InChIInChI=1S/2Cu.2Ga.2In.3S/q;;2*+3;;;3*-2
InChIKeyHISQFTORMKIXQW-UHFFFAOYSA-N
XLogP-1.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500592.38
LogP ≤ 5-1.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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copper
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Frequently Asked Questions

What is the IUPAC name of CID 173033903?
The IUPAC name of CID 173033903 (CID 173033903) is not available.
What is the SMILES notation for CID 173033903?
The canonical SMILES for CID 173033903 is [Cu].[Cu].[Ga+3].[Ga+3].[In].[In].[S-2].[S-2].[S-2].
What is the InChIKey of CID 173033903?
The InChIKey is HISQFTORMKIXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/2Cu.2Ga.2In.3S/q;;2*+3;;;3*-2.
What are the key properties of CID 173033903?
CID 173033903 has a molecular weight of 592.38 g/mol, XLogP of -1.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173033903 is sourced from PubChem (CID 173033903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).