Abstract
A new compound C6F5N(H)C(O)CH3 pentafluoroacetanilide, which is promising for the formation of coordination compounds with metal cations, is synthesized. Its crystal structure is determined (APEX DUO diffractometer, λMoK α, graphite monochromator, T = 150 K). Crystallographic data for C8H4F5NO are as follows: space group C2/c, a = 18.2460(7) Å, b = 10.5840(4) Å, c = 9.4489(4) Å, β = 116.198(1)°, V = 1637.28(11) Å3, Z = 8. The compound has a molecular structure formed of isolated pentafluoroacetanilide molecules. The average distances in the phenyl ring are 1.39 Å for C-C and 1.34 Å for C-F. The molecular structure of the studied compound is confirmed by 19F and 1H NMR in the solution CCl4/CDCl3 = 1:1 (v:v).
| Original language | English |
|---|---|
| Pages (from-to) | 1201-1204 |
| Number of pages | 4 |
| Journal | Journal of Structural Chemistry |
| Volume | 56 |
| Issue number | 6 |
| DOIs | |
| Publication status | Published - 1 Nov 2015 |
| Externally published | Yes |
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Keywords
- crystal structure
- molecular structure
- NMR
- pentafluoroacetanilide
ASJC Scopus subject areas
- Inorganic Chemistry
- Physical and Theoretical Chemistry
- Materials Chemistry
Cite this
Crystal structure of pentafluoroacetanilide. / Babailov, S. P.; Stabnikov, P. A.; Kuratieva, N. V.; Nikulshin, P. A.; Gromilov, S. A.
In: Journal of Structural Chemistry, Vol. 56, No. 6, 01.11.2015, p. 1201-1204.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - Crystal structure of pentafluoroacetanilide
AU - Babailov, S. P.
AU - Stabnikov, P. A.
AU - Kuratieva, N. V.
AU - Nikulshin, P. A.
AU - Gromilov, S. A.
PY - 2015/11/1
Y1 - 2015/11/1
N2 - A new compound C6F5N(H)C(O)CH3 pentafluoroacetanilide, which is promising for the formation of coordination compounds with metal cations, is synthesized. Its crystal structure is determined (APEX DUO diffractometer, λMoK α, graphite monochromator, T = 150 K). Crystallographic data for C8H4F5NO are as follows: space group C2/c, a = 18.2460(7) Å, b = 10.5840(4) Å, c = 9.4489(4) Å, β = 116.198(1)°, V = 1637.28(11) Å3, Z = 8. The compound has a molecular structure formed of isolated pentafluoroacetanilide molecules. The average distances in the phenyl ring are 1.39 Å for C-C and 1.34 Å for C-F. The molecular structure of the studied compound is confirmed by 19F and 1H NMR in the solution CCl4/CDCl3 = 1:1 (v:v).
AB - A new compound C6F5N(H)C(O)CH3 pentafluoroacetanilide, which is promising for the formation of coordination compounds with metal cations, is synthesized. Its crystal structure is determined (APEX DUO diffractometer, λMoK α, graphite monochromator, T = 150 K). Crystallographic data for C8H4F5NO are as follows: space group C2/c, a = 18.2460(7) Å, b = 10.5840(4) Å, c = 9.4489(4) Å, β = 116.198(1)°, V = 1637.28(11) Å3, Z = 8. The compound has a molecular structure formed of isolated pentafluoroacetanilide molecules. The average distances in the phenyl ring are 1.39 Å for C-C and 1.34 Å for C-F. The molecular structure of the studied compound is confirmed by 19F and 1H NMR in the solution CCl4/CDCl3 = 1:1 (v:v).
KW - crystal structure
KW - molecular structure
KW - NMR
KW - pentafluoroacetanilide
UR - http://www.scopus.com/inward/record.url?scp=84955495843&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=84955495843&partnerID=8YFLogxK
U2 - 10.1134/S002247661506030X
DO - 10.1134/S002247661506030X
M3 - Article
AN - SCOPUS:84955495843
VL - 56
SP - 1201
EP - 1204
JO - Journal of Structural Chemistry
JF - Journal of Structural Chemistry
SN - 0022-4766
IS - 6
ER -