journal: Zeitschrift für Kristallographie - Crystalline Materials

Impact Factor: 1.2

Published since January 1, 1877

Zeitschrift für Kristallographie - Crystalline Materials

ISSN: 2196-7105

Editor-in-chief: Rainer Pöttgen

Edited by: Evgeny Antipov, Elena V. Boldyreva, Karen Friese, Hubert Huppertz, Sandro Jahn, E. R. T. Tiekink

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About this journal

Objective
Zeitschrift für Kristallographie – Crystalline Materials was founded in 1877 by Paul von Groth and is today one of the world’s oldest scientific journals. It offers a place for researchers to present results of their theoretical experimental crystallographic studies. The journal presents significant results on structures and on properties of organic/inorganic substances with crystalline character, periodically ordered, modulated or quasicrystalline on static and dynamic phenomena applying the various methods of diffraction, spectroscopy and microscopy.

Topics

General Aspects
Inorganic Crystal Structures
Organic and Metalorganic (including Biological)
Crystal Structures
Technological Aspects
Computer Programs
Instrumentation
Material Properties

Article formats
Letters, Reviews, Original Papers, Discussions, Book Reviews

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Your benefits:

State-of-the art research results
Theoretical and experimental approach
High quality peer-review

History

Founded in 1877 by Paul von Groth Zeitschrift für Kristallographie – Crystalline Materials is one of the world’s oldest scientific journals.

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Volume 238 Issue 11-12

November 2023

Publicly Available November 27, 2023

Frontmatter

Page range: i-ii

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Publicly Available November 27, 2023

In this issue

Page range: iii-iii

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Inorganic Crystal Structures (Original Paper)

October 9, 2023

Cobalt-bearing adamite from Cap Garonne, Mine du Pradet, France – structural relationship to olivenite and magnetic behavior

Christian Paulsen, Maximilian Kai Reimann, Michael Holtkamp, Valérie Galéa-Clolus, Uwe Karst, Rainer Pöttgen

Page range: 355-362

Abstract

The crystal structure of cobalt-bearing adamite (Zn, Co) 2 AsO 4 OH (so-called cobalton adamite) from Mine du Pradet, Cap Garonne, France has been refined from single crystal X-ray diffraction data: Pnnm , a = 831.39(4), b = 852.67(6), c = 605.84(6) pm, w R = 0.0568, 901 F 2 values, 48 variables. The composition of the single crystal and the bulk sample with EDX and ICP-OES was determined as Zn 1.94 Co 0.06 (AsO 4 )OH and (Co 0.085 Ni 0.037 Cu 0.270 Zn 1.608 )AsO 4 OH. The Co 2+ , Ni 2+ and Cu 2+ incorporation in the bulk sample leads to Curie paramagnetism with an experimental moment of 2.85 µ B / M 2+ cation and explains the pink color along with the greenish edges. The Raman spectrum shows the characteristic vibrations of the AsO 4 tetrahedra and the M O 5 pyramids as well as the O–H stretching mode. The adamite structure is closely related with the olivenite type (space group P 2 1 / n 11). This structural relationship is discussed on the basis of a group–subgroup scheme (Bärnighausen formalism).

Organic and Metalorganic Crystal Structures (Original Paper)

October 2, 2023

Series of new cobalt (II) and nickel (II) trinuclear fluorotrifluoroacetates with tetrahydrofuran – contribution to the inverse coordination chemistry and unique cations

Mikhail E. Buzoverov, Tatyana Yu. Glazunova, Victoria E. Gontcharenko, Igor V. Morozov

Page range: 363-371

Abstract

The six new trinuclear fluorocarboxylates with tetrahydrofuran (THF) molecules as terminal ligands are presented. The structures of compounds have been determined by single-crystal X-ray diffraction. According to the structure data, complexes of nickel (II) and cobalt (II) form isomorphous series, namely [K(CF 3 COOH) 6 ][M 3 (μ 3 -F)(CF 3 COO) 6 (THF) 3 ] (M = Co ( I ) and Ni ( II )), Na[M 3 (μ 3 -F)(CF 3 COO) 6 (THF)(CF 3 COOH) 2 ] (M = Co ( III ) and Ni ( IV )) and [Li(CF 3 COOH) 4 ][M 3 (μ 3 -F)(CF 3 COO) 6 (THF) 3 ] (M = Co ( V ) and Ni ( VI )). In crystal structures of I , II , V and VI , previously unknown cations [K(CF 3 COOH) 6 ] + and [Li(CF 3 COOH) 4 ] + have been detected. All substances were studied by IR spectroscopy, and bands sensitive to the nature of metal atoms included in the compounds have been found. The inverse coordination of tridentate fluoride-ion in cobalt (II) and nickel (II) fluorocarboxylates is discussed in the article.

October 30, 2023

Helical self-assembly of an unusual pseudopeptide: crystallographic evidence

Arpita Dutta, Suven Das, Purak Das

Page range: 373-378

Abstract

Pseudopeptides are a versatile class of organic building blocks having potential applications in a wide range of domains. In the current study, N and C termini protected l -alanine based short pseudopeptide was synthesized, where 5-aminoisophthalic acid (5-AIA), a rigid non-proteogenic γ-amino butyric acid was incorporated as C-terminal residue. The single crystal X-ray analysis revealed that the l -Ala residue of the aforesaid peptide adopts ϕ and ψ values characteristic of polyproline II conformation. Self-assembly of the pseudopeptide seems to represent a supramolecular helical architecture via NH⋯O, CH⋯O hydrogen bonding and π–π interactions.

Ahead of Print / Just Accepted

Ahead of Print / Just Accepted

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Journal Impact Factor	1.2	2022, Journal Citation Reports (Clarivate, 2023)
5-year Journal Impact Factor	1.2	2022, Journal Citation Reports (Clarivate, 2023)
Journal Citation Indicator	0.59	2022, Journal Citation Reports (Clarivate, 2023)
CiteScore	2.8	2022, Scopus (Elsevier B.V., 2023)
SCImago Journal Rank	0.354	2022, SJR (Scimago Lab, 2023; Data Source: Scopus)
Source Normalized Impact per Paper	0.581	2022, CWTS Journal Indicators (CWTS B.V., 2023; Data Source: Scopus)

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Editorial

Editor-in-Chief
Rainer Pöttgen, Münster, Germany
pottgen@uni-muenster.de

Editors
Evgeny Antipov, Moscow, Russia
antipov@icr.chem.msu.ru
Elena Boldyreva, Novosibirsk, Russian Federation
eboldyreva@yahoo.com
Karen Friese, Jülich, Germany
k.friese@fz-juelich.de
Hubert Huppertz, Innsbruck, Austria
hubert.huppertz@uibk.ac.at
Sandro Jahn, Köln, Germany
s.jahn@uni-koeln.de
Edward R. T. Tiekink, Bandar Sunway, Malaysia
Edward.Tiekink@gmail.com

Advisory Board
José Antonio Alonso, Spain
Ross Angel, Italy
Elena V. Boldyreva, Russia
Daniel Chateigner, France
Peter Gille, Germany
Sergey V. Krivovichev, Russia
Andreas Leineweber, Germany
Emil Makovicky, Denmark
Kunio Miki, Japan
Rainer Niewa, Germany
Lars Öhrström, Sweden
Bogdan Palosz, Poland
Dhananjai Pandey, India
Thomas Proffen, USA
Jürgen Schreuer, Germany
Hiroyuki Takakura, Japan
Björn Winkler, Germany
Takamitsu Yamanaka, USA

Journal Editor
Birgit Zoglmeier
Birgit.Zoglmeier@degruyter.com

(Deutsch)

Online ISSN: 2196-7105
Print ISSN: 2194-4946
Type: Journal
Language: English
Publisher: De Gruyter (O)
First published: January 1, 1877
Publication Frequency: 12 Issues per Year
Audience: researchers in the field of crystallographic studies