Research output: Contribution to journal › Article › peer-review
Crystal Structure of the Heteroligand Complex [(2-Br-5-MePy)2CoCl2] · (2-Br-5-MePy) : Formation of Supramolecular Associates due to the Halogen Bond. / Adonin, S. A.; Novikov, A. S.; Fedin, V. P.
In: Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya, Vol. 46, No. 1, 01.2020, p. 37-41.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Crystal Structure of the Heteroligand Complex [(2-Br-5-MePy)2CoCl2] · (2-Br-5-MePy)
T2 - Formation of Supramolecular Associates due to the Halogen Bond
AU - Adonin, S. A.
AU - Novikov, A. S.
AU - Fedin, V. P.
PY - 2020/1
Y1 - 2020/1
N2 - The reaction of CoCl2 with 2-bromo-5-methylpyridine (2-Br-5-MePy) in ethanol affords the het-eroligand complex [(2-Br-5-MePy)2CoCl2] · (2-Br-5-MePy) (I), the structure of which is determined by X-ray diffraction analysis (СIF file ССDС no. 1921405). Specific noncovalent interactions Cl···Br (halogen bond) are observed in the crystal structure and lead to the formation of unidimensional supramolecular polymers. The energies of these contacts are determined using quantum-chemical methods.
AB - The reaction of CoCl2 with 2-bromo-5-methylpyridine (2-Br-5-MePy) in ethanol affords the het-eroligand complex [(2-Br-5-MePy)2CoCl2] · (2-Br-5-MePy) (I), the structure of which is determined by X-ray diffraction analysis (СIF file ССDС no. 1921405). Specific noncovalent interactions Cl···Br (halogen bond) are observed in the crystal structure and lead to the formation of unidimensional supramolecular polymers. The energies of these contacts are determined using quantum-chemical methods.
KW - cobalt
KW - crystal structure
KW - halogen bond
KW - N-donor ligands
KW - quantum-chemical calculations
KW - HALIDES
KW - FE CONTACTS
KW - HYDROGEN-BOND
KW - DONOR
KW - COORDINATION
KW - NONCOVALENT INTERACTIONS
KW - BR
KW - METALS
KW - COMPETITION
KW - M-X
UR - http://www.scopus.com/inward/record.url?scp=85081955650&partnerID=8YFLogxK
UR - https://www.mendeley.com/catalogue/b02ed9a2-6503-3d40-b239-0eefc384eec9/
U2 - 10.1134/S1070328420010017
DO - 10.1134/S1070328420010017
M3 - Article
AN - SCOPUS:85081955650
VL - 46
SP - 37
EP - 41
JO - Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya
JF - Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya
SN - 1070-3284
IS - 1
ER -
ID: 23875588