cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.25505/fiz.icsd.cc2dhw1v
title: CSD 2219787: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhw2w
title: CSD 2219788: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhw3x
title: CSD 2219789: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhr4t
title: CSD 2219666: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhw4y
title: CSD 2219790: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhr5v
title: CSD 2219667: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhr6w
title: CSD 2219668: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhr7x
title: CSD 2219669: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhr8y
title: CSD 2219670: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhr9z
title: CSD 2219671: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhrb0
title: CSD 2219672: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhrc1
title: CSD 2219673: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhrd2
title: CSD 2219674: Experimental Crystal Structure Determination

description: Related Article: Daniel Günther, Carsten Paulmann, Oliver Oeckler|2023|J.Solid State Chem.|323|124009|doi:10.1016/j.jssc.2023.124009
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dgwd5
title: CSD 2218837: Experimental Crystal Structure Determination

description: Related Article: Kejun Bu, Tonghuan Fu, Ziwan Du, Xin Feng, Dong Wang, Zhongyang Li, Songhao Guo, Zongdong Sun, Hui Luo, Gang Liu, Yang Ding, Tianyou Zhai, Qian Li, Xujie Lü|2023|Chem.Mater.|35|242|doi:10.1021/acs.chemmater.2c03066
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2dhnrb
title: CSD 2219592: Experimental Crystal Structure Determination

description: Related Article: Kejun Bu, Tonghuan Fu, Ziwan Du, Xin Feng, Dong Wang, Zhongyang Li, Songhao Guo, Zongdong Sun, Hui Luo, Gang Liu, Yang Ding, Tianyou Zhai, Qian Li, Xujie Lü|2023|Chem.Mater.|35|242|doi:10.1021/acs.chemmater.2c03066
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2c30dx
title: CCDC 2177638: Experimental Crystal Structure Determination

description: Related Article: Jingjing Pang|2022|CSD Communication|||
description: Related Article: Jing‐Jing Pang, Zhao‐Quan Yao, Kuo Zhang, Quan‐Wen Li, Zi‐Xuan Fu, Ran Zheng, Wei Li, Jian Xu, Xian‐He Bu|2023|Angew.Chem.,Int.Ed.|62|e202217456|doi:10.1002/anie.202217456
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: 10.25505/fiz.icsd.cc2dhtj8
title: CSD 2219740: Experimental Crystal Structure Determination

description: Related Article: Srikanth Balijapelly, Santhoshkumar Sundaramoorthy, Dibya Jyoti Mondal, Sanjit Konar, Nikolay Gerasimchuk, Aleksandr Chernatynskiy, Amitava Choudhury|2023|Inorg.Chem.|62|3886|doi:10.1021/acs.inorgchem.2c04237
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n.1
title: ethyl 5-amino-1H-pyrazole-4-carboxylate
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

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/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9), and canonical SMILES descriptor[cheminf_000007]: CCOC(=O)c1c[nH]nc1N, and by the IUPAC name[cheminf_000107]: ethyl 5-amino-1~{H}-pyrazole-4-carboxylate.
 
 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-37759

 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:0000601 | heteronuclear multiple bond coherence (HMBC)
 
 CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)
 
 CHMO:0000599 | correlation spectroscopy (COSY)
 
 CHMO:0000604 | heteronuclear single quantum coherence (HSQC)
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0000596 | distortionless enhancement with polarization transfer (DEPT)
 
 CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 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/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 13C NMR (100 MHz, Chloroform-d [77.2 ppm], ppm) δ = 164.7 (Cq), 154.0 (Cq), 136.2 (CH), 98.0 (Cq), 60.0 (CH2), 14.6 (CH3).
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000596.1
title: distortionless enhancement with polarization transfer (DEPT) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000604
title: heteronuclear single quantum coherence (HSQC) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for heteronuclear single quantum coherence (HSQC)
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000601
title: heteronuclear multiple bond coherence (HMBC) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for heteronuclear multiple bond coherence (HMBC)
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 1H NMR (400 MHz, DMSO-d6 [2.50 ppm], ppm) δ = 11.92 (br.s, 1H), 7.56 (s, 1H), 5.76 (br.s, 2H), 4.15 (q, J = 7.0 Hz, 2H), 1.24 (t, J = 7.1 Hz, 3H).
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000596
title: distortionless enhancement with polarization transfer (DEPT) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for distortionless enhancement with polarization transfer (DEPT)
DOI: 10.14272/ypxghkwojxqlqu-uhfffaoysa-n/chmo0000599
title: correlation spectroscopy (COSY) (ethyl 5-amino-1~{H}-pyrazole-4-carboxylate)
title: InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-8-9-5(4)7/h3H,2H2,1H3,(H3,7,8,9)

description: dataset for correlation spectroscopy (COSY)
DOI: 10.6084/m9.figshare.24873999
title: Supplementary Material for: Thymic innervation impairment in experimental autoimmune encephalomyelitis

description: The thymus is the primary lymphoid organ responsible for normal T-cell development. Yet, in abnormal metabolic conditions as well as an acute infection, the organ exhibits morphological and cellular alterations. It is well established that the immune system is in a tidy connection and dependent on the central nervous system (CNS), which regulates thymic function by means of innervation and neurotransmitters. Sympathetic innervation leaves the CNS and spreads through thymic tissue, where nerve endings interact directly or indirectly with thymic cells contributing to their maintenance and development. Herein, we hypothesized that brain damage due to an inflammatory process might elicit alterations upon the thymic-CNS neuroimmune axis, altering not just the sympathetic innervation and neurotransmitter release, but also modifying the thymus microenvironment and T cell development. We used the well-established multiple sclerosis model of experimental autoimmune encephalomyelitis (EAE), to study putative changes in the thymic neural, lymphoid, and microenvironmental compartments. We showed that along with EAE clinical development, thymus morphology, and cellular compartments are affected, altering the peripheric T cell population and modifying the retrograde thymic communication towards the CNS. Altogether, our data suggest that the thymic-CNS neuroimmune bidirectional axis is compromised in EAE. This imbalance may contribute to an increased and uncontrolled auto-immune reaction.
DOI: 10.6084/m9.figshare.24873999.v1
title: Supplementary Material for: Thymic innervation impairment in experimental autoimmune encephalomyelitis

description: The thymus is the primary lymphoid organ responsible for normal T-cell development. Yet, in abnormal metabolic conditions as well as an acute infection, the organ exhibits morphological and cellular alterations. It is well established that the immune system is in a tidy connection and dependent on the central nervous system (CNS), which regulates thymic function by means of innervation and neurotransmitters. Sympathetic innervation leaves the CNS and spreads through thymic tissue, where nerve endings interact directly or indirectly with thymic cells contributing to their maintenance and development. Herein, we hypothesized that brain damage due to an inflammatory process might elicit alterations upon the thymic-CNS neuroimmune axis, altering not just the sympathetic innervation and neurotransmitter release, but also modifying the thymus microenvironment and T cell development. We used the well-established multiple sclerosis model of experimental autoimmune encephalomyelitis (EAE), to study putative changes in the thymic neural, lymphoid, and microenvironmental compartments. We showed that along with EAE clinical development, thymus morphology, and cellular compartments are affected, altering the peripheric T cell population and modifying the retrograde thymic communication towards the CNS. Altogether, our data suggest that the thymic-CNS neuroimmune bidirectional axis is compromised in EAE. This imbalance may contribute to an increased and uncontrolled auto-immune reaction.
DOI: 10.6084/m9.figshare.24873996
title: <b>Breaking the </b><b>S</b><b>ilence: Unveiling the </b><b>P</b><b>otential of the CSRC's Registration Inquiry to </b><b>I</b><b>mprove </b><b>C</b><b>ompany</b><b> </b><b>D</b><b>isclosure and IPO </b><b>P</b><b>ricing</b>

description: 中国证监会; 罗氏磷;信息D是闭合的;IPO P定价;LDA 主题模型
DOI: 10.6084/m9.figshare.24873996.v1
title: <b>Breaking the </b><b>S</b><b>ilence: Unveiling the </b><b>P</b><b>otential of the CSRC's Registration Inquiry to </b><b>I</b><b>mprove </b><b>C</b><b>ompany</b><b> </b><b>D</b><b>isclosure and IPO </b><b>P</b><b>ricing</b>

description: 中国证监会; 罗氏磷;信息D是闭合的;IPO P定价;LDA 主题模型
DOI: 10.6084/m9.figshare.24874012
title: R script from Resource adaptation drives the size-complexity rule in termites

description: R code to reproduce all analyses and figures.
DOI: 10.6084/m9.figshare.24874015
title: Data table on species traits from Resource adaptation drives the size-complexity rule in termites

description: Data table used in the comparative analysis.
DOI: 10.6084/m9.figshare.24874015.v1
title: Data table on species traits from Resource adaptation drives the size-complexity rule in termites

description: Data table used in the comparative analysis.
DOI: 10.6084/m9.figshare.24874018
title: Phylogenetic tree from Resource adaptation drives the size-complexity rule in termites

description: Newick file containing the used phylogenetic tree.
DOI: 10.6084/m9.figshare.24874018.v1
title: Phylogenetic tree from Resource adaptation drives the size-complexity rule in termites

description: Newick file containing the used phylogenetic tree.
DOI: 10.5281/zenodo.10409106
title: Anomalous and Chern topological waves in hyperbolic networks

description: Data and codes for the paper "Anomalous and Chern topological waves in hyperbolic networks", by Q. Chen et al.
DOI: 10.5281/zenodo.10409107
title: Anomalous and Chern topological waves in hyperbolic networks

description: Data and codes for the paper "Anomalous and Chern topological waves in hyperbolic networks", by Q. Chen et al.
DOI: 10.17028/rd.lboro.24873993
title: Supplementary information files for A facile solid state synthesis route to tantalum oxynitride, β-TaON

description: © the authors, CC-BY 4.0Supplementary files for article A facile solid state synthesis route to tantalum oxynitride, β-TaONTantalum oxynitride is a prospective pigment and has attracted considerable recent attention as a photocatalyst for the overall splitting of water under visible light irradiation. Conventionally, TaON is synthesised by the thermal ammonolysis of Ta<sub>2</sub>O<sub>5</sub>, a process in which remains challenging to scale up. The use of ammonia/water or ammonia/oxygen within a narrow temperature window is required to produce high purity TaON material; otherwise Ta<sub>3</sub>N<sub>5</sub> forms as the favoured ammonolysis product. It would be highly beneficial to develop a reliable, simpler and reproducible synthesis route to TaON without the use of gaseous ammonia under such complex conditions. This paper describes a facile synthesis route to monoclinic β-TaON (space group P2<sub>1</sub>/c) using Ta<sub>3</sub>N<sub>5</sub> itself as a solid state nitrogen source. After 6 h of reaction at 900 °C under vacuum followed by post-synthesis calcination at 580 °C for 30 min, the bright yellow oxynitride is produced as spherical particles ca. 80 nm in diameter with a direct band gap of 2.9 eV.