2,4,6-Trinitrophenyl 3-chlorobenzoate

Moreno-Fuquen, Rodolfo; Mosquera, Fabricio; Ellena, Javier; Simone, C. A. De; Tenório, Juan C.

doi:10.1107/s1600536813013792

Cited by 3 publications

(1 citation statement)

References 14 publications

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“…The nitro groups form dihedral angles with the adjacent benzene ring of 19.96 (14)°, 4.07 (20)° and 55.79 (9)° for O1-N1-O2, O3-N2-O4 and O5-N3-O6, respectively. The structure is essentially isotypic with the known chloro compound (Moreno-Fuquen et al, 2013c), thus the packing shows the same structural relationship as discussed for the chlorobenzoate. The molecules are packed through weak C-H•••O interactions forming a three dimensional network (see Table 1, Nardelli, 1995).…”

Section: S1 Commentmentioning

confidence: 56%

2,4,6-Trinitrophenyl 3-bromobenzoate

et al. 2014

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In the title picryl-substituted ester, C13H6BrN3O8, the mean plane of the central ester C–O–C(=O)–C fragment (r.m.s. deviation= 0.0186 Å) is rotated by 84.73 (7)° and 19.92 (12)° to the picryl and phenyl rings, respectively. In the crystal, the molecules are linked by C—H⋯O interactions, forming centrosymmetric dimers enclosing R 2 2(10) and R 2 2(22) ring motifs along [001] and further helical chains of dimers enclosing R 2 2(10) ring motifs along [010].

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Section: S1 Commentmentioning

confidence: 56%

2,4,6-Trinitrophenyl 3-bromobenzoate

et al. 2014

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2,4,6-Trinitrophenyl 4-bromobenzoate

Moreno-Fuquen

2013

Acta Cryst E

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In the title benzoate derivative, C13H6BrN3O8, the benzene rings form a dihedral angle of 80.90 (9)°. The ester moiety forms dihedral angles of 3.2 (2) and 82.8 4(10)° with the benzene and picryl rings, respectively. The Br atom is disordered over two positions, with the site occupancy for the minor component being 0.48 (4). The crystal structure features C—H⋯O interactions, which generate a three-dimensional network.

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4-Formyl-2-nitrophenyl 2-chlorobenzoate

et al. 2013

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In the title compound, C14H8ClNO5, the benzene rings form a dihedral angle of 19.55 (9)°. The mean plane of the central ester group [r.m.s. deviation = 0.024 Å] forms dihedral angles of 53.28 (13) and 36.93 (16)°, respectively, with the nitro- and chloro-substituted rings. The nitro group forms a dihedral angle of 19.24 (19)° with the benzene ring to which it is attached. In the crystal, molecules are linked by weak C—H⋯O hydrogen bonds, forming C(7) chains, which run along [100].

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2,4,6-Trinitrophenyl 3-chlorobenzoate

Cited by 3 publications

References 14 publications

2,4,6-Trinitrophenyl 3-bromobenzoate

2,4,6-Trinitrophenyl 3-bromobenzoate

2,4,6-Trinitrophenyl 4-bromobenzoate

4-Formyl-2-nitrophenyl 2-chlorobenzoate

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