cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.11
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39495

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.12
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39499

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.11
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.11
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.9
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.9
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.10
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39491

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.2
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39459

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.1
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.1
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.6
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.6
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.7
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39479

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.3
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39463

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.2
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.2
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.3
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.4
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39467

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.3
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.4
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.5
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39471

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.4
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g.6
title: C30H16Cu6O22
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7, and canonical SMILES descriptor[cheminf_000007]: [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-39475

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000225 | spectroscopic ellipsometry (SE)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.5
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.5
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000156.8
title: X-ray diffraction (XRD) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/ihuuetijadxdfp-uhfffaoysa-g/chmo0000225.8
title: spectroscopic ellipsometry (SE) ()
title: InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7

description: dataset for spectroscopic ellipsometry (SE)