Literature DB >> 23476521

Diethyl 1,8-diphenyl-11-oxatricyclo-[6.2.1.0(2,7)]undeca-2,4,6-triene-9,10-dicarboxyl-ate.

B Balakrishnan1, Meganathan Nandakumar, P R Seshadri, Arasambattu K Mohanakrishnan.   

Abstract

The title compound, C28H26O5, is the Diels-Alder adduct from 1,3-diphenyl-benzo[c]furan and diethyl maleate. The mol-ecule comprises of a fused tricyclic system containing two five-membered rings, which are in envelope conformations with the O atom at the flap, and a six-membered ring adopting a boat conformation. The dihedral angle between phenyl substituents in the 1,8-positions is 55.1 (1)°. The ethyl groups are disordered over two sets of sites, with occupancy ratios of 0.648 (9):0.352 (9) and 0.816 (1):0.184 (1). In the crystal, pairs of C-H⋯π inter-actions link the mol-ecules into inversion dimers.

Entities:  

Year:  2013        PMID: 23476521      PMCID: PMC3588525          DOI: 10.1107/S1600536813002791

Source DB:  PubMed          Journal:  Acta Crystallogr Sect E Struct Rep Online        ISSN: 1600-5368


  6 in total

1.  A short history of SHELX.

Authors:  George M Sheldrick
Journal:  Acta Crystallogr A       Date:  2007-12-21       Impact factor: 2.290

2.  Structural features of aliphatic N-nitrosamines of 7-azabicyclo[2.2.1]heptanes that facilitate N-NO bond cleavage.

Authors:  T Ohwada; M Miura; H Tanaka; S Sakamoto; K Yamaguchi; H Ikeda; S Inagaki
Journal:  J Am Chem Soc       Date:  2001-10-24       Impact factor: 15.419

3.  Crystal structure of Diels-Alder cycloadduct formed from 1-(1,2,3-1H-benzotriazol-1-yl)-2-(4-methylphenyl)-2H-isoindole and dimethyl acetylenedicarboxylate.

Authors:  Ichiro Takahashi; Mikio Tsuzuki; Hidehiko Kitajima; Minoru Hatanaka; Shiro Maeda; Akihito Yamano; Tomihisa Ohta; Shinzo Hosoi
Journal:  Anal Sci       Date:  2003-06       Impact factor: 2.081

4.  6-[Bis(ethoxycarbonyl)methyl]-6-deoxy-1,2;3,4-di-O-isopropyl-idene-d-galacto-pyran-ose.

Authors:  Bogdan Doboszewski; Paulo R da Silva; Alexander Y Nazarenko; Victor N Nemykin
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2010-11-17

5.  Methyl (9aR*,10S*,11R*,13aS*,13bS*)-9-oxo-6,7,9,9a,10,11-hexa-hydro-5H,13bH-11,13a-ep-oxy-pyrrolo-[2',1':3,4][1,4]diazepino[2,1-a]isoindole-10-carboxyl-ate.

Authors:  Flavien A A Toze; Inga K Airiyan; Eugeniya V Nikitina; Elena A Sorokina; Victor N Khrustalev
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2011-10-05

6.  Structure validation in chemical crystallography.

Authors:  Anthony L Spek
Journal:  Acta Crystallogr D Biol Crystallogr       Date:  2009-01-20
  6 in total
  2 in total

1.  Dimethyl 1-(4-methyl-phen-yl)-8-(thio-phen-2-yl)-11-oxatricyclo-[6.2.1.0(2,7)]undeca-2,4,6,9-tetra-ene-9,10-dicarboxy-late.

Authors:  B Balakrishnan; Meganathan Nandakumar; Pandamangalam R Seshadri; Arasambattu K Mohanakrishnan
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2013-03-06

2.  Dimethyl 1,8-bis-(4-methyl-phen-yl)-11-oxatri-cyclo-[6.2.1.0(2,7)]undeca-2,4,6,9-tetra-ene-9,10-di-carboxyl-ate.

Authors:  B Balakrishnan; Meganathan Nandakumar; P R Seshadri; Arasambattu K Mohanakrishnan
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2013-05-25
  2 in total

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