Structures by: Sandford G.

Total: 51

2-fluoro-1,3-diphenyl-1,3-propanedione

C15H11FO2

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=13.2572(6)Å   b=5.1221(2)Å   c=16.7741(8)Å

α=90°   β=97.5575(19)°   γ=90°

2-fluoro-1,3-bis(4-methylphenyl)-1,3-propandione

C17H15FO2

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=11.1604(8)Å   b=11.7655(8)Å   c=10.8190(8)Å

α=90°   β=114.3180(17)°   γ=90°

2-fluoro-1,3-bis(4-methylphenyl)-1,3-propandione

C17H15FO2

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=8.5592(5)Å   b=12.9739(8)Å   c=12.3376(8)Å

α=90°   β=102.4067(17)°   γ=90°

2-fluoro-1,3-bis(4-chlorophenyl)-1,3-propanedione

C15H9Cl2FO2

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=6.0944(8)Å   b=30.676(4)Å   c=6.8810(9)Å

α=90°   β=90°   γ=90°

2-fluoro-1,3-bis(4-methoxyphenyl)-1,3-propanedione

C17H15FO4

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=31.944(2)Å   b=7.0229(5)Å   c=6.1827(5)Å

α=90°   β=90°   γ=90°

2-fluoro-1,3-bis(4'-fluorophenyl)-1,3-propanedione

C15H9F3O2

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=28.403(2)Å   b=6.1029(4)Å   c=6.9953(5)Å

α=90°   β=102.753(3)°   γ=90°

C24H16F18N2O6

C24H16F18N2O6

Chambers, Richard D.Hoskin, Philip R.Kenwright, Alan R.Khalil, AliRichmond, PaulSandford, GrahamYufit, Dmitrii S.Howard, Judith A. K.

Organic & Biomolecular Chemistry (2003) 1, 12 2137

a=10.771(1)Å   b=11.765(1)Å   c=12.279(1)Å

α=69.53(1)°   β=85.10(1)°   γ=85.96(1)°

C24H16F18N2O6

C24H16F18N2O6

Chambers, Richard D.Hoskin, Philip R.Kenwright, Alan R.Khalil, AliRichmond, PaulSandford, GrahamYufit, Dmitrii S.Howard, Judith A. K.

Organic & Biomolecular Chemistry (2003) 1, 12 2137

a=11.0542(4)Å   b=14.1784(5)Å   c=18.7552(6)Å

α=90.00°   β=102.960(1)°   γ=90.00°

C30H12F18N2O4

C30H12F18N2O4

Chambers, Richard D.Hoskin, Philip R.Kenwright, Alan R.Khalil, AliRichmond, PaulSandford, GrahamYufit, Dmitrii S.Howard, Judith A. K.

Organic & Biomolecular Chemistry (2003) 1, 12 2137

a=13.473(3)Å   b=23.261(5)Å   c=11.079(2)Å

α=90.00°   β=113.78(3)°   γ=90.00°

4-[1-(trifluoromethyl)-1,2,2,2-tetrafluoroethyl]- 2-bromo-3-fluoro-5-methoxy-6-piperidylpyridine

C14H13BrF8N2O

Richard D. ChambersPhilip R. HoskinGraham SandfordDmitrii S. YufitJudith A. K. Howard

Journal of the Chemical Society, Perkin Transactions 1 (2001) 2788-2795

a=10.530(2)Å   b=13.802(3)Å   c=11.485(2)Å

α=90.00°   β=90.86(3)°   γ=90.00°

2,6-dibromo-3-fluoro-5-methoxy-4-(1,2,2,2-tetra- fluoro-1-trifluoromethyl-ethyl)-pyridine

C9H3Br2F8NO

Richard D. ChambersPhilip R. HoskinGraham SandfordDmitrii S. YufitJudith A. K. Howard

Journal of the Chemical Society, Perkin Transactions 1 (2001) 2788-2795

a=10.446(2)Å   b=7.122(1)Å   c=17.251(4)Å

α=90.00°   β=93.71(3)°   γ=90.00°

(S)-methyl 3-fluoro-2-oxopiperidine-3-carboxylate

C7H10FNO3

Willis, Nicky J.Fisher, Craig A.Alder, Catherine M.Harsanyi, AntalShukla, LenaAdams, Joseph P.Sandford, Graham

Green Chem. (2016) 18, 5 1313

a=8.5224(4)Å   b=10.3050(5)Å   c=9.1442(4)Å

α=90.00°   β=90.3404(11)°   γ=90.00°

Dimethyl (2-aminopropyl)fluoromalonate hydrochloride

Cl,C8H15FNO4

Willis, Nicky J.Fisher, Craig A.Alder, Catherine M.Harsanyi, AntalShukla, LenaAdams, Joseph P.Sandford, Graham

Green Chem. (2016) 18, 5 1313

a=5.8210(4)Å   b=6.4875(5)Å   c=15.7485(12)Å

α=100.738(7)°   β=96.625(6)°   γ=94.612(6)°

Cl,C7H13FNO4

Cl,C7H13FNO4

Willis, Nicky J.Fisher, Craig A.Alder, Catherine M.Harsanyi, AntalShukla, LenaAdams, Joseph P.Sandford, Graham

Green Chem. (2016) 18, 5 1313

a=12.2350(7)Å   b=11.3068(7)Å   c=7.6415(4)Å

α=90.00°   β=100.2891(17)°   γ=90.00°

(rac)-methyl 3-fluoro-2-oxopiperidine-3-carboxylate

C7H10FNO3

Willis, Nicky J.Fisher, Craig A.Alder, Catherine M.Harsanyi, AntalShukla, LenaAdams, Joseph P.Sandford, Graham

Green Chem. (2016) 18, 5 1313

a=12.2560(4)Å   b=6.72544(17)Å   c=10.4787(4)Å

α=90.00°   β=113.193(4)°   γ=90.00°

Methyl 3-fluoro-2-oxo-3-pyrrolidinecarboxylate

C6H8FNO3,H2O

Willis, Nicky J.Fisher, Craig A.Alder, Catherine M.Harsanyi, AntalShukla, LenaAdams, Joseph P.Sandford, Graham

Green Chem. (2016) 18, 5 1313

a=6.5648(7)Å   b=6.6759(7)Å   c=9.6206(10)Å

α=98.163(3)°   β=100.929(3)°   γ=101.047(3)°

(R)-methyl 3-fluoro-2-oxopiperidine-3-carboxylate

C7H10FNO3

Willis, Nicky J.Fisher, Craig A.Alder, Catherine M.Harsanyi, AntalShukla, LenaAdams, Joseph P.Sandford, Graham

Green Chem. (2016) 18, 5 1313

a=8.5211(3)Å   b=10.3039(3)Å   c=9.1547(3)Å

α=90.00°   β=90.3650(8)°   γ=90.00°

Dimethyl fluoromalonate

C5H7FO4

Harsanyi, AntalSandford, Graham

Green Chem. (2015) 17, 5 3000

a=6.1459(4)Å   b=10.5542(6)Å   c=9.5004(5)Å

α=90.00°   β=93.777(2)°   γ=90.00°

Trans-cyclohexane-1,4-diol

C6H12O2

Chambers, Richard D.Diter, PatrickDunn, Stephen N.Farren, ChristopherSandford, GrahamBatsanov, Andrei S.Howard, Judith A. K.

Journal of the Chemical Society, Perkin Transactions 1 (2000) 10 1639

a=6.374(1)Å   b=21.313(5)Å   c=7.328(2)Å

α=90.00°   β=95.864(10)°   γ=90.00°

Cis-1,3-di(2H-hexafluoropropyl)-cyclohexane-1,3-diol

C12H12F12O2

Chambers, Richard D.Diter, PatrickDunn, Stephen N.Farren, ChristopherSandford, GrahamBatsanov, Andrei S.Howard, Judith A. K.

Journal of the Chemical Society, Perkin Transactions 1 (2000) 10 1639

a=10.590(2)Å   b=39.347(3)Å   c=15.135(5)Å

α=90.00°   β=94.60(1)°   γ=90.00°

Trans-1,3-di-(2H-hexafluoropropyl)-cyclopentane-1,3-diol

C11H10F12O2

Chambers, Richard D.Diter, PatrickDunn, Stephen N.Farren, ChristopherSandford, GrahamBatsanov, Andrei S.Howard, Judith A. K.

Journal of the Chemical Society, Perkin Transactions 1 (2000) 10 1639

a=12.651(1)Å   b=10.436(1)Å   c=22.301(2)Å

α=90.00°   β=103.69(1)°   γ=90.00°

Trans-1,4-di(1,1,2,3,3,3-hexafluoropropyl)-cyclohexane-1,4-diol

C12H12F12O2

Chambers, Richard D.Diter, PatrickDunn, Stephen N.Farren, ChristopherSandford, GrahamBatsanov, Andrei S.Howard, Judith A. K.

Journal of the Chemical Society, Perkin Transactions 1 (2000) 10 1639

a=14.6732(16)Å   b=10.8011(19)Å   c=18.8818(17)Å

α=90.00°   β=90.904(8)°   γ=90.00°

2-fluoro-1,3-bis(4'-fluorophenyl)-1,3-propanedione

C15H9F3O2

Rozatian, NeshatAshworth, Ian W.Sandford, GrahamHodgson, David R. W.

Chemical science (2018) 9, 46 8692-8702

a=4.3647(4)Å   b=11.5018(10)Å   c=12.3118(11)Å

α=90°   β=94.065(3)°   γ=90°

1-Chloromethyl-4-aza-1-azoniabicyclo[2.2.2]octane tetrafluoroborate deuterochloroform solvate

C7H14ClN2,BF4,CDCl3

Batsanov, Andrei S.Trmcic, JelenaSandford, Graham

Acta Crystallographica Section E (2005) 61, 3 o681-o682

a=22.368(3)Å   b=8.4961(11)Å   c=7.4726(10)Å

α=90°   β=90°   γ=90°

Perfluoro 6-isopropyl-2,4,5-trimethyl-benzenecarbonitrile

C13F17N

Batsanov, Andrei S.Richmond, PaulSandford, GrahamChambers, Richard D.

Acta Crystallographica Section E (2005) 61, 1 o45-o46

a=9.5210(10)Å   b=9.4100(10)Å   c=17.426(2)Å

α=90.00°   β=103.440(10)°   γ=90.00°

4,5,6-trifluoropyridazin-3(2H)-one

C4HF3N2O

Graham PattisonGraham SandfordDmitry S. YufitJudith A. K. HowardJohn A. ChristopherDavid D. Miller

Journal of Organic Chemistry (2009) 74, 5533-5540

a=10.5739(15)Å   b=4.9342(7)Å   c=9.7643(13)Å

α=90.00°   β=100.17(4)°   γ=90.00°

C12H19N5O2

C12H19N5O2

Graham PattisonGraham SandfordDmitry S. YufitJudith A. K. HowardJohn A. ChristopherDavid D. Miller

Journal of Organic Chemistry (2009) 74, 5533-5540

a=7.9081(11)Å   b=9.3887(11)Å   c=10.1211(18)Å

α=101.189(10)°   β=112.835(10)°   γ=102.974(10)°

4-(benzylamino)-5,6-difluoropyridazin-3(2H)-one

C11H9F2N3O

Graham PattisonGraham SandfordDmitry S. YufitJudith A. K. HowardJohn A. ChristopherDavid D. Miller

Journal of Organic Chemistry (2009) 74, 5533-5540

a=5.5843(4)Å   b=7.7332(5)Å   c=23.7937(15)Å

α=95.333(2)°   β=95.092(2)°   γ=90.950(2)°

5-(butylamino)-4,6-difluoropyridazin-3(2H)-one

C8H11F2N3O

Graham PattisonGraham SandfordDmitry S. YufitJudith A. K. HowardJohn A. ChristopherDavid D. Miller

Journal of Organic Chemistry (2009) 74, 5533-5540

a=15.0815(4)Å   b=24.6147(6)Å   c=5.0146(1)Å

α=90.00°   β=90.00°   γ=90.00°

Methyl 2-fluoro-2-(2-nitrophenyl)acetate

C9H8FNO4

Harsanyi, AntalSandford, GrahamYufit, Dmitri S.Howard, Judith Ak

Beilstein journal of organic chemistry (2014) 10, 1213-1219

a=7.2946(7)Å   b=16.473(2)Å   c=7.7761(11)Å

α=90.00°   β=90.00°   γ=90.00°

Diethyl 2-fluoro-2-(2-nitrophenyl)-malonate

C13H14FNO6

Harsanyi, AntalSandford, GrahamYufit, Dmitri S.Howard, Judith Ak

Beilstein journal of organic chemistry (2014) 10, 1213-1219

a=7.6353(11)Å   b=8.0212(17)Å   c=12.559(3)Å

α=88.846(19)°   β=76.201(17)°   γ=66.218(17)°

2-fluoromethyl-3-nitropyridine

C6H5FN2O2

Harsanyi, AntalSandford, GrahamYufit, Dmitri S.Howard, Judith Ak

Beilstein journal of organic chemistry (2014) 10, 1213-1219

a=5.6568(3)Å   b=15.4823(9)Å   c=7.1654(4)Å

α=90.00°   β=96.767(2)°   γ=90.00°

C14H13F2N3O2S

C14H13F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=7.7158(1)Å   b=9.1000(1)Å   c=10.1603(2)Å

α=94.951(1)°   β=99.041(1)°   γ=97.375(1)°

C14H13F2N3O2S

C14H13F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=8.3219(1)Å   b=15.8421(2)Å   c=11.3786(2)Å

α=90.00°   β=109.4290(10)°   γ=90.00°

C16H17F2N3O2S

C16H17F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=13.1516(8)Å   b=9.8626(6)Å   c=13.2963(8)Å

α=90.00°   β=114.265(2)°   γ=90.00°

C25H19F2N3O2S

C25H19F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=18.7318(4)Å   b=9.9214(2)Å   c=23.5820(5)Å

α=90.00°   β=90.00°   γ=90.00°

C14H13F2N3O2S

C14H13F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=10.1943(5)Å   b=10.5803(6)Å   c=14.7937(8)Å

α=105.942(2)°   β=103.247(2)°   γ=105.640(2)°

C9H10F3N3

C9H10F3N3

Graham SandfordRachel SlaterDmitrii S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 7208-7216

a=17.7013(7)Å   b=6.9932(3)Å   c=16.8375(6)Å

α=90.00°   β=118.152(1)°   γ=90.00°

C21H18F3N3

C21H18F3N3

Graham SandfordRachel SlaterDmitrii S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 7208-7216

a=7.4427(1)Å   b=14.1667(2)Å   c=16.6939(3)Å

α=90.00°   β=90.00°   γ=90.00°

C10H13F2N3O

C10H13F2N3O

Graham SandfordRachel SlaterDmitrii S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 7208-7216

a=5.3233(2)Å   b=13.1981(5)Å   c=14.7664(6)Å

α=90.00°   β=96.62(2)°   γ=90.00°

C11H15F2N3O

C11H15F2N3O

Graham SandfordRachel SlaterDmitrii S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 7208-7216

a=8.7228(3)Å   b=18.3386(7)Å   c=7.2367(3)Å

α=90.00°   β=99.587(2)°   γ=90.00°

Trans-fluoro-(2-nitro-3,4,5,6-tetrafluorophenyl)-bis(triphenylphosphino)- palladium(ii)

C42H30F5NO2P2Pd

Matthew R. CargillGraham SandfordAndrezj J. TadeusiakDmitrii S. YufitJudith A. K. HowardPinar KilickiranGabrielle Nelles

Journal of Organic Chemistry (2010) 75, 5860-5866

a=12.9604(4)Å   b=13.9264(3)Å   c=20.6986(5)Å

α=90.00°   β=105.49(1)°   γ=90.00°

2,3,4,5-tetrafluoro-6-nitro-[1,1':4',1"-terphenyl]

C18H9F4NO2

Matthew R. CargillGraham SandfordAndrezj J. TadeusiakDmitrii S. YufitJudith A. K. HowardPinar KilickiranGabrielle Nelles

Journal of Organic Chemistry (2010) 75, 5860-5866

a=6.2677(3)Å   b=9.9095(5)Å   c=12.4290(6)Å

α=82.398(10)°   β=85.577(10)°   γ=72.896(10)°

2,3,5-trifluoro-N,N-dimethyl-4-nitroaniline

C8H7F3N2O2

Matthew R. CargillGraham SandfordAndrezj J. TadeusiakDmitrii S. YufitJudith A. K. HowardPinar KilickiranGabrielle Nelles

Journal of Organic Chemistry (2010) 75, 5860-5866

a=8.0491(4)Å   b=9.1029(4)Å   c=11.7075(5)Å

α=90.00°   β=94.49(3)°   γ=90.00°

2,4,5-trifluoro-6-nitrobiphenyl

C12H6F3NO2

Matthew R. CargillGraham SandfordAndrezj J. TadeusiakDmitrii S. YufitJudith A. K. HowardPinar KilickiranGabrielle Nelles

Journal of Organic Chemistry (2010) 75, 5860-5866

a=11.6280(2)Å   b=12.1588(2)Å   c=14.4292(2)Å

α=90.00°   β=90.00°   γ=90.00°

2,3,4,5-tetrafluoro-6-nitrobiphenyl

C12H5F4NO2

Matthew R. CargillGraham SandfordAndrezj J. TadeusiakDmitrii S. YufitJudith A. K. HowardPinar KilickiranGabrielle Nelles

Journal of Organic Chemistry (2010) 75, 5860-5866

a=7.6907(5)Å   b=11.4847(8)Å   c=11.9766(8)Å

α=90.00°   β=92.53(2)°   γ=90.00°

4-(piperidino)-5,6-difluoropyridazin-3(2H)-one

C9H11F2N3O

Graham PattisonGraham SandfordDmitry S. YufitJudith A. K. HowardJohn A. ChristopherDavid D. Miller

Journal of Organic Chemistry (2009) 74, 5533-5540

a=13.4744(9)Å   b=4.7342(4)Å   c=14.8788(9)Å

α=90.00°   β=96.41(2)°   γ=90.00°

C13H11F2N3O2S

C13H11F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=14.4972(4)Å   b=8.1056(2)Å   c=10.8247(3)Å

α=90.00°   β=95.1420(10)°   γ=90.00°

C15H15F2N3O2S

C15H15F2N3O2S

Aurelie BaronGraham SandfordRachel SlaterDmitry S. YufitJudith A. K. HowardAntonio Vong

Journal of Organic Chemistry (2005) 70, 9377-9381

a=21.3729(5)Å   b=9.7107(2)Å   c=14.4801(3)Å

α=90.00°   β=90.00°   γ=90.00°

2,3,4-trifluoro-6-nitrobiphenyl

C12H6F3NO2

Matthew R. CargillGraham SandfordAndrezj J. TadeusiakDmitrii S. YufitJudith A. K. HowardPinar KilickiranGabrielle Nelles

Journal of Organic Chemistry (2010) 75, 5860-5866

a=12.5365(7)Å   b=7.5063(4)Å   c=11.0598(6)Å

α=90.00°   β=97.89(2)°   γ=90.00°