Structural Chemistry, volume 28, issue 6, pages 1927-1934

Asymmetric triiodide-diiodine interactions in the crystal of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide

Publication typeJournal Article
Publication date2017-06-23
Quartile SCImago
Q3
Quartile WOS
Q3
Impact factor1.7
ISSN10400400, 15729001
Physical and Theoretical Chemistry
Condensed Matter Physics
Abstract
The crystal structure and properties of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide (C2/c) synthesized from the initial bis(4-сhloro-5H-1,2,3-dithiazolo-5-ylidene)benzene-1,2-diamine (P21/c) have been characterized by various experimental and theoretic methods. The superposition of atomic basin boundaries in the electron density and in the electrostatic potential does not confirm the halogen bonding between the triiodide anion and sulfur atoms in cation. On the other hand, in the studied oligoiodide, the charge-assisted iodine–iodine halogen bonds are observed between the strongly asymmetric triiodide and diiodine units; thus, the oligoiodide anion includes at least two diiodine fragments with bond lengths 2.7334(4) and 2.7786(5) Å bound. This key trait has resulted in characteristic spectral and thermal features. Raman spectra do not contain typical triiodide bands but only those that are expectable for bound diiodine at 157 and 179 cm−1. Thermal decomposition has demonstrated release of both diiodine molecules within one decomposition stage without melting.

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Bolshakov O. I. et al. Asymmetric triiodide-diiodine interactions in the crystal of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide // Structural Chemistry. 2017. Vol. 28. No. 6. pp. 1927-1934.
GOST all authors (up to 50) Copy
Bolshakov O. I., Yushina I. D., Bartashevich E. V., Nelyubina Y. V., Aysin R. R., Rakitin O. A. Asymmetric triiodide-diiodine interactions in the crystal of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide // Structural Chemistry. 2017. Vol. 28. No. 6. pp. 1927-1934.
RIS |
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TY - JOUR
DO - 10.1007/s11224-017-0987-y
UR - https://doi.org/10.1007%2Fs11224-017-0987-y
TI - Asymmetric triiodide-diiodine interactions in the crystal of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide
T2 - Structural Chemistry
AU - Bolshakov, O I
AU - Yushina, I. D.
AU - Bartashevich, E. V.
AU - Nelyubina, Y V
AU - Aysin, R. R.
AU - Rakitin, O A
PY - 2017
DA - 2017/06/23 00:00:00
PB - Springer Nature
SP - 1927-1934
IS - 6
VL - 28
SN - 1040-0400
SN - 1572-9001
ER -
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@article{2017_Bolshakov
author = {O I Bolshakov and I. D. Yushina and E. V. Bartashevich and Y V Nelyubina and R. R. Aysin and O A Rakitin},
title = {Asymmetric triiodide-diiodine interactions in the crystal of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide},
journal = {Structural Chemistry},
year = {2017},
volume = {28},
publisher = {Springer Nature},
month = {jun},
url = {https://doi.org/10.1007%2Fs11224-017-0987-y},
number = {6},
pages = {1927--1934},
doi = {10.1007/s11224-017-0987-y}
}
MLA
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Bolshakov, O. I., et al. “Asymmetric triiodide-diiodine interactions in the crystal of (Z)-4-chloro-5-((2-((4-chloro-5H-1,2,3-dithiazol-5-ylidene)amino)phenyl)amino)-1,2,3-dithiazol-1-ium oligoiodide.” Structural Chemistry, vol. 28, no. 6, Jun. 2017, pp. 1927-1934. https://doi.org/10.1007%2Fs11224-017-0987-y.
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