CCDC 2281269: Experimental Crystal Structure Determination Article Swipe

View

Jogirdas Vainauskas , Tristan H. Borchers , Mihails Arhangelskis , Laura J. McCormick , Toni S. Spilfogel , Ehsan Hamzehpoor , Filip Topić , Simon J. Coles , Dmitrii F. Perepichka , Christopher J. Barrett , Tomislav Friščić ·

YOU? · · 2023 · Open Access · · DOI: https://doi.org/10.5517/ccdc.csd.cc2gkvb7

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.

Related Topics

Concepts

Crystallography Materials science Archaeology Art Geography Chemistry

Metadata

Type: dataset
Language: en
Landing Page: https://doi.org/10.5517/ccdc.csd.cc2gkvb7
OA Status: green
Related Works: 10
OpenAlex ID: https://openalex.org/W4397746670

All OpenAlex metadata

Raw OpenAlex JSON

OpenAlex ID: https://openalex.org/W4397746670

Canonical identifier for this work in OpenAlex
DOI: https://doi.org/10.5517/ccdc.csd.cc2gkvb7

Digital Object Identifier
Title: CCDC 2281269: Experimental Crystal Structure Determination

Work title
Type: dataset

OpenAlex work type
Language: en

Primary language
Publication year: 2023

Year of publication
Publication date: 2023-11-07

Full publication date if available
Authors: Jogirdas Vainauskas, Tristan H. Borchers, Mihails Arhangelskis, Laura J. McCormick, Toni S. Spilfogel, Ehsan Hamzehpoor, Filip Topić, Simon J. Coles, Dmitrii F. Perepichka, Christopher J. Barrett, Tomislav Friščić

List of authors in order
Landing page: https://doi.org/10.5517/ccdc.csd.cc2gkvb7

Publisher landing page
Open access: Yes

Whether a free full text is available
OA status: green

Open access status per OpenAlex
OA URL: https://doi.org/10.5517/ccdc.csd.cc2gkvb7

Direct OA link when available
Concepts: Crystallography, Materials science, Archaeology, Art, Geography, Chemistry

Top concepts (fields/topics) attached by OpenAlex
Cited by: 0

Total citation count in OpenAlex
Related works (count): 10

Other works algorithmically related by OpenAlex

Full payload

id	https://openalex.org/W4397746670
doi	https://doi.org/10.5517/ccdc.csd.cc2gkvb7
ids.doi	https://doi.org/10.5517/ccdc.csd.cc2gkvb7
ids.openalex	https://openalex.org/W4397746670
fwci
type	dataset
title	CCDC 2281269: Experimental Crystal Structure Determination
biblio.issue
biblio.volume
biblio.last_page
biblio.first_page
topics[0].id	https://openalex.org/T11881
topics[0].field.id	https://openalex.org/fields/25
topics[0].field.display_name	Materials Science
topics[0].score	0.9879999756813049
topics[0].domain.id	https://openalex.org/domains/3
topics[0].domain.display_name	Physical Sciences
topics[0].subfield.id	https://openalex.org/subfields/2505
topics[0].subfield.display_name	Materials Chemistry
topics[0].display_name	Crystallization and Solubility Studies
topics[1].id	https://openalex.org/T12613
topics[1].field.id	https://openalex.org/fields/25
topics[1].field.display_name	Materials Science
topics[1].score	0.9376999735832214
topics[1].domain.id	https://openalex.org/domains/3
topics[1].domain.display_name	Physical Sciences
topics[1].subfield.id	https://openalex.org/subfields/2505
topics[1].subfield.display_name	Materials Chemistry
topics[1].display_name	X-ray Diffraction in Crystallography
is_xpac	False
apc_list
apc_paid
concepts[0].id	https://openalex.org/C8010536
concepts[0].level	1
concepts[0].score	0.4724987745285034
concepts[0].wikidata	https://www.wikidata.org/wiki/Q160398
concepts[0].display_name	Crystallography
concepts[1].id	https://openalex.org/C192562407
concepts[1].level	0
concepts[1].score	0.4162037968635559
concepts[1].wikidata	https://www.wikidata.org/wiki/Q228736
concepts[1].display_name	Materials science
concepts[2].id	https://openalex.org/C166957645
concepts[2].level	1
concepts[2].score	0.34802383184432983
concepts[2].wikidata	https://www.wikidata.org/wiki/Q23498
concepts[2].display_name	Archaeology
concepts[3].id	https://openalex.org/C142362112
concepts[3].level	0
concepts[3].score	0.32798057794570923
concepts[3].wikidata	https://www.wikidata.org/wiki/Q735
concepts[3].display_name	Art
concepts[4].id	https://openalex.org/C205649164
concepts[4].level	0
concepts[4].score	0.2964742183685303
concepts[4].wikidata	https://www.wikidata.org/wiki/Q1071
concepts[4].display_name	Geography
concepts[5].id	https://openalex.org/C185592680
concepts[5].level	0
concepts[5].score	0.21514776349067688
concepts[5].wikidata	https://www.wikidata.org/wiki/Q2329
concepts[5].display_name	Chemistry
keywords[0].id	https://openalex.org/keywords/crystallography
keywords[0].score	0.4724987745285034
keywords[0].display_name	Crystallography
keywords[1].id	https://openalex.org/keywords/materials-science
keywords[1].score	0.4162037968635559
keywords[1].display_name	Materials science
keywords[2].id	https://openalex.org/keywords/archaeology
keywords[2].score	0.34802383184432983
keywords[2].display_name	Archaeology
keywords[3].id	https://openalex.org/keywords/art
keywords[3].score	0.32798057794570923
keywords[3].display_name	Art
keywords[4].id	https://openalex.org/keywords/geography
keywords[4].score	0.2964742183685303
keywords[4].display_name	Geography
keywords[5].id	https://openalex.org/keywords/chemistry
keywords[5].score	0.21514776349067688
keywords[5].display_name	Chemistry
language	en
locations[0].id	doi:10.5517/ccdc.csd.cc2gkvb7
locations[0].is_oa	True
locations[0].source.id	https://openalex.org/S4397694588
locations[0].source.issn
locations[0].source.type	repository
locations[0].source.is_oa	False
locations[0].source.issn_l
locations[0].source.is_core	False
locations[0].source.is_in_doaj	False
locations[0].source.display_name	The Cambridge Structural Database
locations[0].source.host_organization	https://openalex.org/I4210098980
locations[0].source.host_organization_name	Cambridge Crystallographic Data Centre
locations[0].source.host_organization_lineage	https://openalex.org/I4210098980
locations[0].license
locations[0].pdf_url
locations[0].version
locations[0].raw_type	dataset
locations[0].license_id
locations[0].is_accepted	False
locations[0].is_published
locations[0].raw_source_name
locations[0].landing_page_url	https://doi.org/10.5517/ccdc.csd.cc2gkvb7
indexed_in	datacite
authorships[0].author.id	https://openalex.org/A5028944096
authorships[0].author.orcid	https://orcid.org/0000-0001-7060-0931
authorships[0].author.display_name	Jogirdas Vainauskas
authorships[0].author_position	first
authorships[0].raw_author_name	Vainauskas, Jogirdas
authorships[0].is_corresponding	False
authorships[1].author.id	https://openalex.org/A5090838477
authorships[1].author.orcid
authorships[1].author.display_name	Tristan H. Borchers
authorships[1].author_position	middle
authorships[1].raw_author_name	Borchers, Tristan H.
authorships[1].is_corresponding	False
authorships[2].author.id	https://openalex.org/A5000025271
authorships[2].author.orcid	https://orcid.org/0000-0003-1150-3108
authorships[2].author.display_name	Mihails Arhangelskis
authorships[2].author_position	middle
authorships[2].raw_author_name	Arhangelskis, Mihails
authorships[2].is_corresponding	False
authorships[3].author.id	https://openalex.org/A5073462382
authorships[3].author.orcid	https://orcid.org/0000-0002-6634-4717
authorships[3].author.display_name	Laura J. McCormick
authorships[3].author_position	middle
authorships[3].raw_author_name	McPherson, Laura J. McCormick
authorships[3].is_corresponding	False
authorships[4].author.id	https://openalex.org/A5089825367
authorships[4].author.orcid	https://orcid.org/0000-0002-4989-0070
authorships[4].author.display_name	Toni S. Spilfogel
authorships[4].author_position	middle
authorships[4].raw_author_name	Spilfogel, Toni S.
authorships[4].is_corresponding	False
authorships[5].author.id	https://openalex.org/A5017996250
authorships[5].author.orcid	https://orcid.org/0000-0002-5427-9444
authorships[5].author.display_name	Ehsan Hamzehpoor
authorships[5].author_position	middle
authorships[5].raw_author_name	Hamzehpoor, Ehsan
authorships[5].is_corresponding	False
authorships[6].author.id	https://openalex.org/A5050264456
authorships[6].author.orcid	https://orcid.org/0000-0003-3811-6036
authorships[6].author.display_name	Filip Topić
authorships[6].author_position	middle
authorships[6].raw_author_name	Topić, Filip
authorships[6].is_corresponding	False
authorships[7].author.id	https://openalex.org/A5014634951
authorships[7].author.orcid	https://orcid.org/0000-0001-8414-9272
authorships[7].author.display_name	Simon J. Coles
authorships[7].author_position	middle
authorships[7].raw_author_name	Coles, Simon J.
authorships[7].is_corresponding	False
authorships[8].author.id	https://openalex.org/A5034303836
authorships[8].author.orcid	https://orcid.org/0000-0003-2233-416X
authorships[8].author.display_name	Dmitrii F. Perepichka
authorships[8].author_position	middle
authorships[8].raw_author_name	Perepichka, Dmytro F.
authorships[8].is_corresponding	False
authorships[9].author.id	https://openalex.org/A5087518548
authorships[9].author.orcid	https://orcid.org/0000-0001-6194-9066
authorships[9].author.display_name	Christopher J. Barrett
authorships[9].author_position	middle
authorships[9].raw_author_name	Barrett, Christopher J.
authorships[9].is_corresponding	False
authorships[10].author.id	https://openalex.org/A5088974934
authorships[10].author.orcid	https://orcid.org/0000-0002-3921-7915
authorships[10].author.display_name	Tomislav Friščić
authorships[10].author_position	last
authorships[10].raw_author_name	Friščić, Tomislav
authorships[10].is_corresponding	False
has_content.pdf	False
has_content.grobid_xml	False
is_paratext	False
open_access.is_oa	True
open_access.oa_url	https://doi.org/10.5517/ccdc.csd.cc2gkvb7
open_access.oa_status	green
open_access.any_repository_has_fulltext	False
created_date	2025-10-10T00:00:00
display_name	CCDC 2281269: Experimental Crystal Structure Determination
has_fulltext	False
is_retracted	False
updated_date	2025-11-06T06:51:31.235846
primary_topic.id	https://openalex.org/T11881
primary_topic.field.id	https://openalex.org/fields/25
primary_topic.field.display_name	Materials Science
primary_topic.score	0.9879999756813049
primary_topic.domain.id	https://openalex.org/domains/3
primary_topic.domain.display_name	Physical Sciences
primary_topic.subfield.id	https://openalex.org/subfields/2505
primary_topic.subfield.display_name	Materials Chemistry
primary_topic.display_name	Crystallization and Solubility Studies
related_works	https://openalex.org/W4387497383, https://openalex.org/W3183948672, https://openalex.org/W3173606202, https://openalex.org/W3110381201, https://openalex.org/W2948807893, https://openalex.org/W2935909890, https://openalex.org/W2778153218, https://openalex.org/W2758277628, https://openalex.org/W2748952813, https://openalex.org/W1531601525
cited_by_count	0
locations_count	1
best_oa_location.id	doi:10.5517/ccdc.csd.cc2gkvb7
best_oa_location.is_oa	True
best_oa_location.source.id	https://openalex.org/S4397694588
best_oa_location.source.issn
best_oa_location.source.type	repository
best_oa_location.source.is_oa	False
best_oa_location.source.issn_l
best_oa_location.source.is_core	False
best_oa_location.source.is_in_doaj	False
best_oa_location.source.display_name	The Cambridge Structural Database
best_oa_location.source.host_organization	https://openalex.org/I4210098980
best_oa_location.source.host_organization_name	Cambridge Crystallographic Data Centre
best_oa_location.source.host_organization_lineage	https://openalex.org/I4210098980
best_oa_location.license
best_oa_location.pdf_url
best_oa_location.version
best_oa_location.raw_type	dataset
best_oa_location.license_id
best_oa_location.is_accepted	False
best_oa_location.is_published	False
best_oa_location.raw_source_name
best_oa_location.landing_page_url	https://doi.org/10.5517/ccdc.csd.cc2gkvb7
primary_location.id	doi:10.5517/ccdc.csd.cc2gkvb7
primary_location.is_oa	True
primary_location.source.id	https://openalex.org/S4397694588
primary_location.source.issn
primary_location.source.type	repository
primary_location.source.is_oa	False
primary_location.source.issn_l
primary_location.source.is_core	False
primary_location.source.is_in_doaj	False
primary_location.source.display_name	The Cambridge Structural Database
primary_location.source.host_organization	https://openalex.org/I4210098980
primary_location.source.host_organization_name	Cambridge Crystallographic Data Centre
primary_location.source.host_organization_lineage	https://openalex.org/I4210098980
primary_location.license
primary_location.pdf_url
primary_location.version
primary_location.raw_type	dataset
primary_location.license_id
primary_location.is_accepted	False
primary_location.is_published	False
primary_location.raw_source_name
primary_location.landing_page_url	https://doi.org/10.5517/ccdc.csd.cc2gkvb7
publication_date	2023-11-07
publication_year	2023
referenced_works_count	0
abstract_inverted_index.a	21
abstract_inverted_index.3D	40
abstract_inverted_index.An	0
abstract_inverted_index.is	31
abstract_inverted_index.The	15, 25
abstract_inverted_index.and	37, 48
abstract_inverted_index.for	10, 28
abstract_inverted_index.the	3, 7, 35
abstract_inverted_index.CCDC	36
abstract_inverted_index.cell	42
abstract_inverted_index.data	19
abstract_inverted_index.from	2, 20, 34
abstract_inverted_index.this	29
abstract_inverted_index.entry	1, 16, 30
abstract_inverted_index.small	11
abstract_inverted_index.space	44
abstract_inverted_index.freely	32
abstract_inverted_index.group,	45
abstract_inverted_index.study.	24
abstract_inverted_index.crystal	13, 22
abstract_inverted_index.dataset	27
abstract_inverted_index.quality	49
abstract_inverted_index.contains	17
abstract_inverted_index.includes	39
abstract_inverted_index.molecule	12
abstract_inverted_index.Cambridge	4
abstract_inverted_index.Database,	6
abstract_inverted_index.available	33
abstract_inverted_index.deposited	26
abstract_inverted_index.measures.	50
abstract_inverted_index.typically	38
abstract_inverted_index.world’s	8
abstract_inverted_index.Structural	5
abstract_inverted_index.conditions	47
abstract_inverted_index.repository	9
abstract_inverted_index.diffraction	23
abstract_inverted_index.parameters,	43
abstract_inverted_index.structures.	14
abstract_inverted_index.coordinates,	41
abstract_inverted_index.experimental	18, 46
cited_by_percentile_year
countries_distinct_count	0
institutions_distinct_count	11
citation_normalized_percentile