Automated Organization Profile

Chemisty, University of Helsinki, Finland

Current S-Index

21.6

Sum of Dataset Indices for all datasets

Average Dataset Index per Dataset

0.4

Average Dataset Index per dataset

Total Datasets

55

Total datasets in this organization

Average FAIR Score

18.0%

Average FAIR Score per dataset

Total Citations

0

Total citations to the organization's datasets

Total Mentions

0

Total mentions of the organization's datasets

S-Index Interpretation

S-Index Over Time

Cumulative Citations Over Time

Cumulative Mentions Over Time

Datasets

1H nuclear magnetic resonance spectroscopy (1H NMR) () (Version: 1)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/aunsjxbptzwxpo-uhfffaoysa-n/chmo0000593January 2025

X-ray diffraction (XRD) () (Version: 1)

dataset for X-ray diffraction (XRD)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/fshbhsdbmkawbw-uhfffaoysa-n/chmo0000156January 2025

X-ray diffraction (XRD) (5-bromo-6-nitroisoindole-1,3-dione) (Version: 1)

dataset for X-ray diffraction (XRD)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/ylgnuzyllnkcpd-uhfffaoysa-n/chmo0000156January 2025

5-bromo-6-nitroisoindole-1,3-dione (Version: 1)

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/C8H3BrN2O4/c9-5-1-3-4(2-6(5)11(14)15)8(13)10-7(3)12/h1-2H,(H,10,12,13), and canonical SMILES descriptor[cheminf_000007]: O=C1NC(=O)c2c1cc(N+[O-])c(c2)Br, and by the IUPAC name[cheminf_000107]: 5-bromo-6-nitroisoindole-1,3-dione. 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-29077 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:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR) CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR) CHMO:0001146 | 1H--13C heteronuclear single quantum coherence (1H-13C HSQC) CHMO:0000630 | infrared absorption spectroscopy (IR) CHMO:0000470 | mass spectrometry (MS) CHMO:0000156 | X-ray diffraction (XRD) 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

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions15% FAIR0.3 Dataset Index
10.14272/ylgnuzyllnkcpd-uhfffaoysa-n.1January 2025

mass spectrometry (MS) () (Version: 1)

dataset for mass spectrometry (MS)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.2 Dataset Index
10.14272/dxibaqpvffvwmb-uhfffaoysa-n/chmo0000470January 2025

1H--13C heteronuclear single quantum coherence (1H-13C HSQC) () (Version: 1)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/dxibaqpvffvwmb-uhfffaoysa-n/chmo0001146January 2025

methyl 4-(5,6-dicyano-1-propyl-1H-benzo[d]imidazol-2-yl)benzoate (Version: 1)

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/C20H16N4O2/c1-3-8-24-18-10-16(12-22)15(11-21)9-17(18)23-19(24)13-4-6-14(7-5-13)20(25)26-2/h4-7,9-10H,3,8H2,1-2H3, and canonical SMILES descriptor[cheminf_000007]: CCCn1c(nc2c1cc(C#N)c(c2)C#N)c1ccc(cc1)C(=O)OC, 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-29027 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]: Melting point descriptor[CHEMINF_000256]: 249.8 (°C) 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:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR) CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR) CHMO:0001146 | 1H--13C heteronuclear single quantum coherence (1H-13C HSQC) CHMO:0000630 | infrared absorption spectroscopy (IR) CHMO:0000470 | mass spectrometry (MS) CHMO:0000156 | X-ray diffraction (XRD) 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

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions15% FAIR0.4 Dataset Index
10.14272/dxibaqpvffvwmb-uhfffaoysa-n.1January 2025

X-ray diffraction (XRD) () (Version: 1)

dataset for X-ray diffraction (XRD)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/dxibaqpvffvwmb-uhfffaoysa-n/chmo0000156January 2025

1H nuclear magnetic resonance spectroscopy (1H NMR) () (Version: 1)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/dxibaqpvffvwmb-uhfffaoysa-n/chmo0000593January 2025

13C nuclear magnetic resonance spectroscopy (13C NMR) () (Version: 1)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Authors

  • Langer, Lukas ;
  • Nieger, Martin
0 Citations0 Mentions19% FAIR0.5 Dataset Index
10.14272/dxibaqpvffvwmb-uhfffaoysa-n/chmo0000595January 2025