cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.14272/mjfluagruogvrf-uhfffaoysa-n.2
title: 9-(4-(1-(quinoxalin-2-yl)-1H-1,2,3-triazol-4-yl)phenyl)-9H-carbazole
title: InChI=1S/C28H18N6/c1-5-11-26-21(7-1)22-8-2-6-12-27(22)34(26)20-15-13-19(14-16-20)25-18-33(32-31-25)28-17-29-23-9-3-4-10-24(23)30-28/h1-18H

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/C28H18N6/c1-5-11-26-21(7-1)22-8-2-6-12-27(22)34(26)20-15-13-19(14-16-20)25-18-33(32-31-25)28-17-29-23-9-3-4-10-24(23)30-28/h1-18H, and canonical SMILES descriptor[cheminf_000007]: c1ccc2c(c1)nc(cn2)n1nnc(c1)c1ccc(cc1)n1c2ccccc2c2c1cccc2, 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-33082

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 193.3 - 239.9 (°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:0000470 | mass spectrometry (MS)
 
 CHMO:0000630 | infrared absorption spectroscopy (IR)
 
 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/mjfluagruogvrf-uhfffaoysa-n/chmo0000470.1
title: mass spectrometry (MS) ()
title: InChI=1S/C28H18N6/c1-5-11-26-21(7-1)22-8-2-6-12-27(22)34(26)20-15-13-19(14-16-20)25-18-33(32-31-25)28-17-29-23-9-3-4-10-24(23)30-28/h1-18H

description: dataset for mass spectrometry (MS)
DOI: 10.5517/cc11m33w
title: CCDC 971667: Experimental Crystal Structure Determination

description: Related Article: Erlin Yue, Qifeng Xing, Liping Zhang, Qisong Shi, Xiao-Ping Cao, Lin Wang, Carl Redshaw, Wen-Hua Sun|2014|Dalton Trans.|43|3339|doi:10.1039/C3DT53205D
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4tm
title: CCDC 971720: Experimental Crystal Structure Determination

description: Related Article: Shaoguang Zhang, Ming Zhan, Qifeng Wang, Wen-Xiong Zhang, Zhenfeng Xi|2014|Org.Chem.Front.|1|130|doi:10.1039/c3qo00019b
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.14272/mjfluagruogvrf-uhfffaoysa-n/chmo0000630.1
title: infrared absorption spectroscopy (IR) ()
title: InChI=1S/C28H18N6/c1-5-11-26-21(7-1)22-8-2-6-12-27(22)34(26)20-15-13-19(14-16-20)25-18-33(32-31-25)28-17-29-23-9-3-4-10-24(23)30-28/h1-18H

description: dataset for infrared absorption spectroscopy (IR)
DOI: 10.5517/cc11m4vn
title: CCDC 971721: Experimental Crystal Structure Determination

description: Related Article: Kevin Lamberts, Sven Porsche, Bernd Hentschel, Torsten Kuhlen, Ulli Englert|2014|CrystEngComm|16|3305|doi:10.1039/C3CE42357C
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m5c6
title: CCDC 971737: Experimental Crystal Structure Determination

description: Related Article: Gabriel E. Schneider, Henk J. Bolink, Edwin C. Constable, Cathrin D. Ertl, Catherine E. Housecroft, Antonio Pertegàs, Jennifer A. Zampese, Andreas Kanitz, Florian Kessler, Sebastian B. Meier|2014|Dalton Trans.|43|1961|doi:10.1039/C3DT53229A
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.14272/mjfluagruogvrf-uhfffaoysa-n/chmo0000593.1
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C28H18N6/c1-5-11-26-21(7-1)22-8-2-6-12-27(22)34(26)20-15-13-19(14-16-20)25-18-33(32-31-25)28-17-29-23-9-3-4-10-24(23)30-28/h1-18H

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.5517/cc11m4wp
title: CCDC 971722: Experimental Crystal Structure Determination

description: Related Article: Kevin Lamberts, Sven Porsche, Bernd Hentschel, Torsten Kuhlen, Ulli Englert|2014|CrystEngComm|16|3305|doi:10.1039/C3CE42357C
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4xq
title: CCDC 971723: Experimental Crystal Structure Determination

description: Related Article: Kevin Lamberts, Sven Porsche, Bernd Hentschel, Torsten Kuhlen, Ulli Englert|2014|CrystEngComm|16|3305|doi:10.1039/C3CE42357C
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m45z
title: CCDC 971700: Experimental Crystal Structure Determination

description: Related Article: Y. Odabachian, S. Tong, Q. Wang, M.-X. Wang, J. Zhu|2013|Angew.Chem.,Int.Ed.|52|10878|doi:10.1002/anie.201305506
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4yr
title: CCDC 971724: Experimental Crystal Structure Determination

description: Related Article: Kevin Lamberts, Sven Porsche, Bernd Hentschel, Torsten Kuhlen, Ulli Englert|2014|CrystEngComm|16|3305|doi:10.1039/C3CE42357C
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.34718.86081
title: Art to solve problems.pdf
DOI: 10.5517/cc11jlbh
title: CCDC 969256: Experimental Crystal Structure Determination

description: Related Article: S. R. Sushrutha, Srinivasan Natarajan|2014|CrystEngComm|16|4774|doi:10.1039/C3CE42311E
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m460
title: CCDC 971701: Experimental Crystal Structure Determination

description: Related Article: Y. Odabachian, S. Tong, Q. Wang, M.-X. Wang, J. Zhu|2013|Angew.Chem.,Int.Ed.|52|10878|doi:10.1002/anie.201305506
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11jlcj
title: CCDC 969257: Experimental Crystal Structure Determination

description: Related Article: S. R. Sushrutha, Srinivasan Natarajan|2014|CrystEngComm|16|4774|doi:10.1039/C3CE42311E
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11jldk
title: CCDC 969258: Experimental Crystal Structure Determination

description: Related Article: S. R. Sushrutha, Srinivasan Natarajan|2014|CrystEngComm|16|4774|doi:10.1039/C3CE42311E
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.15468/dl.my8vcu
title: Occurrence Download

description: A dataset containing 136 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Mustela nivalis",
 "HasCoordinate is true",
 "Country is Czechia"
 ]
}

 The dataset includes 136 records from 10 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0049651-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/cc11m482
title: CCDC 971703: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m493
title: CCDC 971704: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4b4
title: CCDC 971705: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4c5
title: CCDC 971706: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4d6
title: CCDC 971707: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.14272/qdyfclvsluzdhb-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (4-ethynyl-N,N-diphenylaniline)
title: InChI=1S/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/qdyfclvsluzdhb-uhfffaoysa-n/chmo0000630
title: infrared absorption spectroscopy (IR) (4-ethynyl-N,N-diphenylaniline)
title: InChI=1S/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H

description: dataset for infrared absorption spectroscopy (IR)
DOI: 10.5517/cc11m4f7
title: CCDC 971708: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4g8
title: CCDC 971709: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.14272/qdyfclvsluzdhb-uhfffaoysa-n/chmo0001148
title: 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC) (4-ethynyl-N,N-diphenylaniline)
title: InChI=1S/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H

description: dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
DOI: 10.5517/cc11m4h9
title: CCDC 971710: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc11m4jb
title: CCDC 971711: Experimental Crystal Structure Determination

description: Related Article: Jacob H. Koffer,  Jacob H. Olshansky,  Matthew D. Smith,  Kristen J. Hernandez,  Matthias Zeller,  Gregory M. Ferrence,  Joshua Schrier,  and Alexander J. Norquist|2013|Cryst.Growth Des.|13|4504|doi:10.1021/cg400992q
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.13140/rg.2.2.28348.76161
title: Anableps
DOI: 10.14272/qdyfclvsluzdhb-uhfffaoysa-n/chmo0000470
title: mass spectrometry (MS) (4-ethynyl-N,N-diphenylaniline)
title: InChI=1S/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H

description: dataset for mass spectrometry (MS)
DOI: 10.14272/qdyfclvsluzdhb-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (4-ethynyl-N,N-diphenylaniline)
title: InChI=1S/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.5517/cc11m53y
title: CCDC 971729: Experimental Crystal Structure Determination

description: Related Article: Gadi Ranjith Kumar, Yalla Kiran Kumar, Ruchir Kant and Maddi Sridhar Reddy|2014|Beilstein J.Org.Chem.|10|1255|doi:10.3762/bjoc.10.125
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.14272/qdyfclvsluzdhb-uhfffaoysa-n.1
title: 4-ethynyl-N,N-diphenylaniline
title: InChI=1S/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H

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/C20H15N/c1-2-17-13-15-20(16-14-17)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h1,3-16H, and canonical SMILES descriptor[cheminf_000007]: C#Cc1ccc(cc1)N(c1ccccc1)c1ccccc1, and by the IUPAC name[cheminf_000107]: 4-ethynyl-N,N-diphenylaniline.
 
 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-32626

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 80.6 - 84.4 (°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:0000470 | mass spectrometry (MS)
 
 CHMO:0000630 | infrared absorption spectroscopy (IR)
 
 CHMO:0001146 | 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
 
 CHMO:0001148 | 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
 
 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: 10.15468/dl.upfcdc
title: Occurrence Download

description: A dataset containing 1371621 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Alopochen aegyptiaca",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Geometry POLYGON ((-27.50298 21.28126, -26.43695 20.42046, -25.1287 19.94015, -23.6919 19.88185, -22.25048 20.2511, 38.59129 21.65886, 40.05275 21.35526, 41.49861 21.47933, 42.80482 22.01995, 43.85759 22.93039, 44.55982 24.13112, 76.4422 55.66586, 78.30868 56.53368, 79.62115 57.65488, 80.22432 58.94387, 79.98464 60.29035, 78.8192 61.56215, -62.74691 58.43671, -63.73428 57.13646, -63.88319 55.78588, -63.26559 54.51539, -61.99922 53.43331, -60.22441 52.62263, -28.2297 22.44742, -27.50298 21.28126))",
 "BasisOfRecord is one of (Human Observation, Machine Observation, Observation, Material sample)"
 ]
}

 The dataset includes 1371621 records from 513 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0049552-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/cc11m561
title: CCDC 971732: Experimental Crystal Structure Determination

description: Related Article: P. Mangwala Kimpende, M. Lusakibanza, K. Mesia, L. Tona, M. Tits, L. Angenot, M. Frédérich, L. Van Meervelt|2013|Acta Crystallogr.,Sect.C:Cryst.Struct.Commun.|69|1557|doi:10.1107/S010827011303117X
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.