Structures published

Total: 118

Phenobarbital dioxane hemisolvate

C₁₂H₁₂N₂O_3,0.5(C₄H₈O₂)

Zencirci, Neslihan Griesser, Ulrich J.Gelbrich, Thomas Kahlenberg, Volker Jetti, Ram K. R.Apperley, David C.Harris, Robin K.

The journal of physical chemistry. B (2014) 118, 12 3267-3280

a=6.86417(15)Å b=11.9645(2)Å c=16.6842(4)Å

α=90° β=98.071(2)° γ=90°

Phenobarbital dichloromethane monosolvate

C₁₂H₁₂N₂O_3,CH₂Cl₂

Zencirci, Neslihan Griesser, Ulrich J.Gelbrich, Thomas Kahlenberg, Volker Jetti, Ram K. R.Apperley, David C.Harris, Robin K.

The journal of physical chemistry. B (2014) 118, 12 3267-3280

a=8.6980(5)Å b=11.9681(6)Å c=14.2590(7)Å

α=90.00° β=97.470(5)° γ=90.00°

Phenobarbital nitromethane monosolvate

C₁₂H₁₂N₂O_3,CH₃NO₂

Zencirci, Neslihan Griesser, Ulrich J.Gelbrich, Thomas Kahlenberg, Volker Jetti, Ram K. R.Apperley, David C.Harris, Robin K.

The journal of physical chemistry. B (2014) 118, 12 3267-3280

a=10.2543(14)Å b=10.4086(15)Å c=13.7090(19)Å

α=98.774(11)° β=96.171(11)° γ=98.962(3)°

Phenobarbital dioxane monosolvate

C₁₂H₁₂N₂O_3,C₄H₈O₂

Zencirci, Neslihan Griesser, Ulrich J.Gelbrich, Thomas Kahlenberg, Volker Jetti, Ram K. R.Apperley, David C.Harris, Robin K.

The journal of physical chemistry. B (2014) 118, 12 3267-3280

a=10.6052(3)Å b=10.5502(2)Å c=14.6810(4)Å

α=90° β=92.028(2)° γ=90°

Phenobarbital dioxane monosolvate

C₁₂H₁₂N₂O_3,C₄H₈O₂

Zencirci, Neslihan Griesser, Ulrich J.Gelbrich, Thomas Kahlenberg, Volker Jetti, Ram K. R.Apperley, David C.Harris, Robin K.

The journal of physical chemistry. B (2014) 118, 12 3267-3280

a=17.639(2)Å b=10.4165(8)Å c=18.374(2)Å

α=90.00° β=108.281(9)° γ=90.00°

Phenobarbital acetonitrile monosolvate

C₁₂H₁₂N₂O_3,C₂H₃N

Zencirci, Neslihan Griesser, Ulrich J.Gelbrich, Thomas Kahlenberg, Volker Jetti, Ram K. R.Apperley, David C.Harris, Robin K.

The journal of physical chemistry. B (2014) 118, 12 3267-3280

a=10.1600(7)Å b=10.3036(11)Å c=14.0553(12)Å

α=99.674(8)° β=96.774(6)° γ=97.811(7)°

Codeine Monohydrate

C₁₈H₂₁NO_3,H₂O

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Molecular pharmaceutics (2014) 11, 9 3145-3163

a=10.3994(2)Å b=12.5671(2)Å c=12.0640(2)Å

α=90° β=90° γ=90°

Codeine Hydrochloride Dihydrate

C₁₈H₂₂NO_31,Cl_1,2(H₂O)

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Molecular pharmaceutics (2014) 11, 9 3145-3163

a=6.7621(5)Å b=12.9315(9)Å c=20.3080(14)Å

α=90° β=90° γ=90°

Codeine Hydrochloride Anhydrate I

C₁₈H₂₂NO_3,Cl

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Molecular pharmaceutics (2014) 11, 9 3145-3163

a=7.14435(17)Å b=13.2304(3)Å c=16.5408(4)Å

α=90° β=90° γ=90°

Ethylmorphine Monohydrate

C₁₉H₂₃NO_3,H₂O

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Molecular pharmaceutics (2014) 11, 9 3145-3163

a=7.08246(18)Å b=13.1493(3)Å c=18.0581(5)Å

α=90° β=90° γ=90°

Ethylmorphine Hydrochloride Dihydrate

C₁₉H₂₄NO_3,Cl_,2(H₂O)

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Molecular pharmaceutics (2014) 11, 9 3145-3163

a=6.8715(2)Å b=13.3924(4)Å c=20.4176(5)Å

α=90° β=90° γ=90°

C₁₄H₁₃N₃O

Hean, D.Gelbrich, T.Griesser, U. J.Michael, J. P.Lemmerer, A.

CrystEngComm (2015) 17, 28 5143

a=13.488(2)Å b=9.6611(15)Å c=9.3604(13)Å

α=90° β=90.183(5)° γ=90°

C₁₄H₁₃N₃O

Hean, D.Gelbrich, T.Griesser, U. J.Michael, J. P.Lemmerer, A.

CrystEngComm (2015) 17, 28 5143

a=25.8998(13)Å b=5.5463(3)Å c=8.3187(4)Å

α=90° β=95.876(4)° γ=90°

C₁₄H₁₃N₃O

Hean, D.Gelbrich, T.Griesser, U. J.Michael, J. P.Lemmerer, A.

CrystEngComm (2015) 17, 28 5143

a=10.2114(2)Å b=30.3315(7)Å c=8.2353(2)Å

α=90° β=110.1930(10)° γ=90°

C₁₄H₁₃N₃O

Hean, D.Gelbrich, T.Griesser, U. J.Michael, J. P.Lemmerer, A.

CrystEngComm (2015) 17, 28 5143

a=6.3542(4)Å b=7.6624(6)Å c=49.231(3)Å

α=90° β=90° γ=90°

Isonicotinic acid-(1-phenyl-ethylidenehydrazide)

C₁₄H₁₃N₃O

Hean, D.Gelbrich, T.Griesser, U. J.Michael, J. P.Lemmerer, A.

CrystEngComm (2015) 17, 28 5143

a=10.6217(16)Å b=14.442(2)Å c=8.2589(12)Å

α=90° β=109.623(5)° γ=90°

C₁₄H₁₃N₃O

Hean, D.Gelbrich, T.Griesser, U. J.Michael, J. P.Lemmerer, A.

CrystEngComm (2015) 17, 28 5143

a=9.7360(6)Å b=9.8752(6)Å c=26.1543(16)Å

α=92.856(4)° β=100.295(4)° γ=91.291(4)°

Carbamazepine dihydrate

C₁₅H₁₂N₂O_,2(H₂O)

Harris, Robin K.Ghi, Phuong Y.Puschmann, Horst Apperley, David C.Griesser, Ulrich J.Hammond, Robert B.Ma, Caiyun Roberts, Kevin J.Pearce, Greg J.Yates, Jonathan R.Pickard, Chris J.

Organic Process Research & Development (2005) 9, 6 902

a=10.066(2)Å b=28.719(5)Å c=4.831(1)Å

α=90.00° β=103.45(1)° γ=90.00°

1,3,5-trihydroxybenzene dihydrate

C₆H₆O_3,2(H₂O)

Braun, Doris E.Tocher, Derek A.Price, Sarah L.Griesser, Ulrich J.

The journal of physical chemistry. B (2012) 116, 13 3961-3972

a=6.6209(17)Å b=13.5606(25)Å c=8.0462(15)Å

α=90° β=90° γ=90°

C₇H₁₁N₂OS_,Br

Braun, Doris Elfriede Lampl, Martin Kahlenberg, Volker Wurst, Klaus Schottenberger, Herwig Hummel, Michael Griesser, Ulrich J.

CrystEngComm (2020)

a=11.2359(2)Å b=14.9020(2)Å c=12.3361(3)Å

α=90° β=111.2210(10)° γ=90°

C₇H₁₁N₂OS_,Cl

Braun, Doris Elfriede Lampl, Martin Kahlenberg, Volker Wurst, Klaus Schottenberger, Herwig Hummel, Michael Griesser, Ulrich J.

CrystEngComm (2020)

a=11.1116(2)Å b=14.6502(3)Å c=12.1138(4)Å

α=90° β=111.270(2)° γ=90°

C₅H₉N₄OS_,Br

Braun, Doris Elfriede Lampl, Martin Kahlenberg, Volker Wurst, Klaus Schottenberger, Herwig Hummel, Michael Griesser, Ulrich J.

CrystEngComm (2020)

a=5.8057(3)Å b=19.4234(11)Å c=8.3009(5)Å

α=90° β=102.153(5)° γ=90°

C₆H₁₀N₃OS_,Br

Braun, Doris Elfriede Lampl, Martin Kahlenberg, Volker Wurst, Klaus Schottenberger, Herwig Hummel, Michael Griesser, Ulrich J.

CrystEngComm (2020)

a=15.1584(6)Å b=6.9422(3)Å c=8.7807(4)Å

α=90° β=90° γ=90°

C₇H₁₁N₂OS_,Cl

Braun, Doris Elfriede Lampl, Martin Kahlenberg, Volker Wurst, Klaus Schottenberger, Herwig Hummel, Michael Griesser, Ulrich J.

CrystEngComm (2020)

a=17.1960(8)Å b=8.4197(5)Å c=6.6408(3)Å

α=90° β=95.281(4)° γ=90°

Aprepitant, form II

C₂₃H₂₁F₇N₄O₃

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Laus, Gerhard Wieser, Josef Griesser, Ulrich J.

New Journal of Chemistry (2008) 32, 10 1677

a=7.7768(16)Å b=7.4072(11)Å c=21.297(5)Å

α=90° β=92.861(17)° γ=90°

Aprepitant, form I

C₂₃H₂₁F₇N₄O₃

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Laus, Gerhard Wieser, Josef Griesser, Ulrich J.

New Journal of Chemistry (2008) 32, 10 1677

a=7.421(4)Å b=7.710(4)Å c=42.200(2)Å

α=90° β=90° γ=90°

3-(3-methylimidazolium-1-yl)propanoate dihydrate

C₇H₁₀N₂O_2,2(H₂O)

Braun, Doris E.Lampl, Martin Wurst, Klaus Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig

CrystEngComm (2018) 20, 48 7826

a=7.3825(4)Å b=8.4170(4)Å c=8.8371(4)Å

α=113.2550(10)° β=105.1800(10)° γ=95.990(2)°

3-(3-methylimidazolium-1-yl)propanoate

C₇H₁₀N₂O₂

Braun, Doris E.Lampl, Martin Wurst, Klaus Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig

CrystEngComm (2018) 20, 48 7826

a=6.6643(4)Å b=8.7065(5)Å c=12.8000(8)Å

α=90° β=90° γ=90°

3-(3-methylimidazolium-1-yl)propanoate monohydrate

C₇H₁₀N₂O_2,H₂O

Braun, Doris E.Lampl, Martin Wurst, Klaus Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig

CrystEngComm (2018) 20, 48 7826

a=7.7258(7)Å b=12.6758(12)Å c=8.8421(9)Å

α=90° β=105.550(10)° γ=90°

1 (2 carboxyethyl)-3-methylimidazolium chloride

C₇H₁₁N₂O_2,Cl

Braun, Doris E.Lampl, Martin Wurst, Klaus Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig

CrystEngComm (2018) 20, 48 7826

a=20.1911(9)Å b=7.9146(3)Å c=22.5627(11)Å

α=90° β=92.268(2)° γ=90°

Dapsone nitromethane hemisolvate

2(C₁₂H₁₂N₂O₂S)_,CH₃NO₂

Braun, Doris E.Gelbrich, Thomas Griesser, Ulrich J.

CrystEngComm (2019) 21, 36 5533

a=8.4167(2)Å b=16.3415(3)Å c=19.1383(4)Å

α=90° β=95.832(2)° γ=90°

Dapsone acetonitrile hemisolvate

2(C₁₂H₁₂N₂O₂S)_,C₂H₃N

Braun, Doris E.Gelbrich, Thomas Griesser, Ulrich J.

CrystEngComm (2019) 21, 36 5533

a=8.5132(2)Å b=16.1830(3)Å c=18.9865(4)Å

α=90° β=97.818(2)° γ=90°

Cinacalcet HCl acetic acid solvate

C₂₄H₂₇ClF₃NO₂

Braun, Doris E.Kahlenberg, Volker Gelbrich, Thomas Ludescher, Johannes Griesser, Ulrich J.

CrystEngComm (2008) 10, 11 1617

a=7.5434(8)Å b=18.575(2)Å c=16.7756(19)Å

α=90° β=90° γ=90°

C₈H₁₆N_,Cl

Laus, Gerhard Bentivoglio, Gino Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig Nauer, Gerhard

CrystEngComm (2008) 10, 6 748

a=6.4857(10)Å b=12.005(3)Å c=12.526(2)Å

α=90.00° β=102.746(13)° γ=90.00°

C₈H₁₄N_,Cl

Laus, Gerhard Bentivoglio, Gino Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig Nauer, Gerhard

CrystEngComm (2008) 10, 6 748

a=8.4849(14)Å b=8.1271(16)Å c=13.501(2)Å

α=90.00° β=100.408(13)° γ=90.00°

Pentobarbital, nembutal

C₁₁H₁₈N₂O₃

Rossi, Denise Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm (2012) 14, 7 2494

a=11.7361(6)Å b=11.1568(9)Å c=10.1886(6)Å

α=90.00° β=110.205(6)° γ=90.00°

Pentobarbital, nembutal

C₁₁H₁₈N₂O₃

Rossi, Denise Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm (2012) 14, 7 2494

a=16.7545(15)Å b=9.8660(8)Å c=7.1799(5)Å

α=90.00° β=90.00° γ=90.00°

Co-crystal phenobarbital + nembutal

(C₁₂H₁₂N₂O₃)_,(C₁₁H₁₈N₂O₃)

Rossi, Denise Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm (2012) 14, 7 2494

a=12.6733(11)Å b=20.6887(19)Å c=10.2529(7)Å

α=90.00° β=118.458(9)° γ=90.00°

Pentobarbital, nembutal

C₁₁H₁₈N₂O₃

Rossi, Denise Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm (2012) 14, 7 2494

a=14.5136(10)Å b=6.8344(3)Å c=12.4979(6)Å

α=90.00° β=104.762(6)° γ=90.00°

Nembutal, pentobarbital

C₁₁H₁₈N₂O₃

Rossi, Denise Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm (2012) 14, 7 2494

a=11.8675(10)Å b=21.824(3)Å c=10.2201(9)Å

α=90.00° β=110.476(9)° γ=90.00°

5,5-dichlorobarbituric acid

C₄H₂Cl₂N₂O₃

Gelbrich, Thomas Rossi, Denise Häfele, Clemens A.Griesser, Ulrich J.

CrystEngComm (2011) 13, 17 5502

a=11.3096(3)Å b=12.9226(4)Å c=29.1608(8)Å

α=90.00° β=90.00° γ=90.00°

5,5-dibromorobarbituric acid

C₄H₂Br₂N₂O₃

Gelbrich, Thomas Rossi, Denise Häfele, Clemens A.Griesser, Ulrich J.

CrystEngComm (2011) 13, 17 5502

a=11.4204(2)Å b=12.9897(3)Å c=30.0304(8)Å

α=90.00° β=90.00° γ=90.00°

5,5-dibromorobarbituric acid

C₄H₂Br₂N₂O₃

Gelbrich, Thomas Rossi, Denise Häfele, Clemens A.Griesser, Ulrich J.

CrystEngComm (2011) 13, 17 5502

a=17.5105(12)Å b=6.6869(3)Å c=13.6714(9)Å

α=90.00° β=110.493(8)° γ=90.00°

5,5-dichlorobarbituric acid

C₄H₂Cl₂N₂O₃

Gelbrich, Thomas Rossi, Denise Häfele, Clemens A.Griesser, Ulrich J.

CrystEngComm (2011) 13, 17 5502

a=11.5440(3)Å b=11.5528(3)Å c=20.0656(5)Å

α=90.00° β=100.481(3)° γ=90.00°

4-aminoquinaldine monohydrate

C₁₀H₁₀N_2,H₂O

Braun, Doris E.Oberacher, Herbert Arnhard, Kathrin Orlova, Maria Griesser, Ulrich J.

CrystEngComm (2016) 18, 22 4053

a=4.7832(5)Å b=12.0775(4)Å c=16.3371(5)Å

α=90.00000° β=92.226(3)° γ=90.00000°

C₈H₁₈N_,Cl

Laus, Gerhard Bentivoglio, Gino Kahlenberg, Volker Griesser, Ulrich J.Schottenberger, Herwig Nauer, Gerhard

CrystEngComm (2008) 10, 6 748

a=10.0354(11)Å b=13.254(2)Å c=14.6231(16)Å

α=90.00° β=90.00° γ=90.00°

Propallylonal, noctal, nostal, quietal, ibomal

C₁₀H₁₃BrN₂O₃

Gelbrich, Thomas Rossi, Denise Häfele, Clemens A.Griesser, Ulrich J.

CrystEngComm (2011) 13, 17 5502

a=8.0916(3)Å b=11.3472(5)Å c=13.2670(4)Å

α=90.00° β=105.773(2)° γ=90.00°

Cytosine/5-flucytosine solid solution I

C₄H_4.359F_0.641N₃O₁

Braun, Doris Elfriede Griesser, Ulrich J.

CrystEngComm (2017)

a=4.00808(9)Å b=9.43931(11)Å c=13.0306(2)Å

α=90° β=91.179(2)° γ=90°

Cytosine/5-flucytosine solid solution I

C₄H_4.393F_0.607N₃O₁

Braun, Doris Elfriede Griesser, Ulrich J.

CrystEngComm (2017)

a=6.67372(5)Å b=6.67372(5)Å c=23.6290(3)Å

α=90° β=90° γ=90°

C₁₂H₁₀F₁₃N₂S_,I

Hummel, Michael Markiewicz, Marta Stolte, Stefan Noisternig, Michael Franz Braun, Doris Elfriede Gelbrich, Thomas Griesser, Ulrich J.Partl, Gabriel Julian Naier, Benjamin Florian Wurst, Klaus Krüger, Biljana Kopacka, Holger Laus, Gerhard Huppertz, Hubert Schottenberger, Herwig

Green Chem. (2017)

a=6.4269(3)Å b=8.9443(5)Å c=16.3677(9)Å

α=85.570(5)° β=81.795(4)° γ=86.766(5)°

C₁₂H₁₀F₁₃N₂S_1,Cl₁

Green Chem. (2017)

a=6.3654(4)Å b=9.2363(5)Å c=16.0361(12)Å

α=75.231(5)° β=83.709(5)° γ=76.855(5)°

2(C₁₂H₁₀F₁₃N₂S₁)_,SiF₆₂

Green Chem. (2017)

a=18.463(5)Å b=8.901(3)Å c=11.595(3)Å

α=90° β=102.185(9)° γ=90°

C₂₀H₁₃F₂₆IN₂S

Green Chem. (2017)

a=5.8881(3)Å b=10.2741(7)Å c=25.4810(10)Å

α=89.763(4)° β=87.419(4)° γ=77.726(3)°

C₁₂H₁₀F₁₃N₂S_1,C₈F₁₇I_,I₁

Green Chem. (2017)

a=6.4954(5)Å b=9.2039(8)Å c=27.9195(19)Å

α=94.848(6)° β=91.767(6)° γ=95.367(7)°

C₁₅H₁₅F₁₃N₂O₃S₂

Green Chem. (2017)

a=8.6657(2)Å b=10.1187(4)Å c=48.601(2)Å

α=90° β=90° γ=90°

4-aminoquinaldine form I

C₁₀H₁₀N₂

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm / RSC (2015) 17, 12 2504-2516

a=5.2162(4)Å b=12.3693(9)Å c=13.1192(9)Å

α=90° β=99.065(3)° γ=90°

4-aminoquinaldine form II

C₁₀H₁₀N_2,C_0.08Cl_0.33

Braun, Doris E.Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

CrystEngComm / RSC (2015) 17, 12 2504-2516

a=28.4074(8)Å b=28.4074(8)Å c=11.9126(5)Å

α=90° β=90° γ=120°

(2S,3R,4R,5S,6R)-2-[4-Chloro-3-(4-ethoxybenzyl)phenyl]-6-(methylsulfanyl)tetrahydro-2H-pyran-3,4,5-triol

C₂₁H₂₅ClO₅S

Gelbrich, Thomas Adamer, Verena Stefinovic, Marijan Thaler, Andrea Griesser, Ulrich J.

Acta Crystallographica Section C (2017) 73, 9

a=5.3945(4)Å b=9.1577(5)Å c=43.475(4)Å

α=90° β=90° γ=90°

(2S,3R,4R,5S,6R)-2-[4-Chloro-3-(4-ethoxybenzyl)phenyl]-6-(methylsulfanyl)tetrahydro-2H-pyran-3,4,5-triol monohydrate

C₂₁H₂₅ClO₅S_,H₂O

Gelbrich, Thomas Adamer, Verena Stefinovic, Marijan Thaler, Andrea Griesser, Ulrich J.

Acta Crystallographica Section C (2017) 73, 9

a=4.4659(3)Å b=9.8994(8)Å c=48.073(5)Å

α=90° β=90° γ=90°

Febuxostat ethanol monosolvate

C₁₆H₁₆N₂O₃S_,C₂H₆O

Gelbrich, Thomas Kahlenberg, Volker Adamer, Verena Nerdinger, Sven Griesser, Ulrich J.

Acta Crystallographica Section E (2020) 76, 6 816-819

a=4.7274(2)Å b=17.7820(5)Å c=10.7340(4)Å

α=90° β=98.994(4)° γ=90°

Methohexital

C₁₄H₁₈N₂O₃

Gelbrich, Thomas Griesser, Ulrich J.

Acta Crystallographica Section E (2015) 71, 2 206-209

a=7.7502(6)Å b=7.9792(5)Å c=12.6881(10)Å

α=93.713(6)° β=96.226(6)° γ=113.314(7)°

Naloxegol hydrogen oxalate

C₃₄H₅₄NO_11,C₂HO₄

Gelbrich, Thomas Langes, Christoph Stefinovic, Marijan Griesser, Ulrich J.

Acta Crystallographica Section E (2018) 74, 4 474-477

a=10.35810(10)Å b=13.40390(10)Å c=26.1689(2)Å

α=90° β=90° γ=90°

5-Hydroxy-5-propylbarbituric acid

C₇H₁₀N₂O₄

Gelbrich, Thomas Griesser, Ulrich J.

Acta Crystallographica Section E (2015) 71, 11 1311-1314

a=10.7862(8)Å b=6.7093(5)Å c=11.7365(6)Å

α=90° β=98.632(6)° γ=90°

Buthalital (Bayinal, Baytinal, Thialbutal, Transithal, Ulbreval)

C₁₁H₁₆N₂O₂S

Gelbrich, Thomas Griesser, Ulrich J.

Acta crystallographica. Section E, Crystallographic communications (2017) 73, Pt 12 1908-1912

a=8.7271(6)Å b=11.6521(4)Å c=12.5400(8)Å

α=90° β=96.539(2)° γ=90°

Methitural (Neraval, Thiogenal)

C₁₂H₂₀N₂O₂S₂

Gelbrich, Thomas Griesser, Ulrich J.

Acta crystallographica. Section E, Crystallographic communications (2017) 73, Pt 12 1908-1912

a=15.1873(2)Å b=9.09200(10)Å c=20.8684(3)Å

α=90° β=96.0830(10)° γ=90°

Alogliptin

C₁₈H₂₁N₅O₂

Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Acta Crystallographica Section C (2013) 69, 6 674-678

a=8.4528(5)Å b=8.5689(5)Å c=12.4424(7)Å

α=87.840(5)° β=72.284(5)° γ=87.368(8)°

Alogliptin benzoate

C₁₈H₂₂N₅O_2,C₇H₅O₂

Gelbrich, Thomas Kahlenberg, Volker Griesser, Ulrich J.

Acta Crystallographica Section C (2013) 69, 6 674-678

a=8.0666(2)Å b=9.8727(2)Å c=28.4593(6)Å

α=90° β=90° γ=90°

5-Cyclohexyl-5-ethylbarbituric acid form I

C₁₂H₁₈N₂O₃

Gelbrich, Thomas Meischberger, Isabella Griesser, Ulrich J.

Acta Crystallographica Section C (2015) 71, 3

a=17.9322(4)Å b=10.4961(3)Å c=13.2006(4)Å

α=90° β=95.896(2)° γ=90°

5-Cyclohexyl-5-ethylbarbituric acid form II

C₁₂H₁₈N₂O₃

Gelbrich, Thomas Meischberger, Isabella Griesser, Ulrich J.

Acta Crystallographica Section C (2015) 71, 3

a=12.5071(7)Å b=21.0741(9)Å c=10.3310(5)Å

α=90° β=116.989(5)° γ=90°

Sulfasymazine

C₁₃H₁₇N₅O₂S

Haddow, Mairi F.Gelbrich, Thomas Griesser, Ulrich J.

Acta Crystallographica Section C (2008) 64, 6 o309-o312

a=9.3257(2)Å b=16.7918(4)Å c=9.8600(2)Å

α=90.00° β=110.6930(10)° γ=90.00°

Sulfatriazine

C₁₁H₁₃N₅O₄S

Haddow, Mairi F.Gelbrich, Thomas Griesser, Ulrich J.

Acta Crystallographica Section C (2008) 64, 6 o309-o312

a=8.1566(3)Å b=8.6577(4)Å c=10.5410(4)Å

α=97.180(3)° β=103.374(2)° γ=109.255(2)°

Narconumal, Enallylpropymal

C₁₁H₁₆N₂O₃

Gelbrich, Thomas Zencirci, Neslihan Griesser, Ulrich J.

Acta Crystallographica Section C (2010) 66, 1 o55-o58

a=6.4160(7)Å b=7.9559(8)Å c=11.9569(12)Å

α=77.574(7)° β=80.837(7)° γ=75.518(6)°

1,5-di(but-2-enyl)-5-ethylbarbituric acid

C₁₄H₂₀N₂O₃

Gelbrich, Thomas Zencirci, Neslihan Griesser, Ulrich J.

Acta Crystallographica Section C (2010) 66, 1 o55-o58

a=10.2825(11)Å b=13.2972(16)Å c=10.3959(10)Å

α=90° β=92.999(7)° γ=90°

Telaprevir

C₃₆H₅₃N₇O₆

Gelbrich, Thomas Kahlenberg, Volker Langes, Christoph Griesser, Ulrich J.

Acta Crystallographica Section C (2013) 69, 2 179-182

a=10.4235(2)Å b=19.1651(2)Å c=37.2907(4)Å

α=90.00° β=90.00° γ=90.00°

Codeine hydrogen dihydrogen phosphate hemihydrate

C₁₈H₂₂NO_3,H₂O₄P_,0.5H₂O

Langes, Christoph Gelbrich, Thomas Griesser, Ulrich J.Kahlenberg, Volker

Acta Crystallographica Section C (2009) 65, 8 o419-o422

a=6.9113(2)Å b=33.4470(9)Å c=8.0716(2)Å

α=90.00° β=99.778(3)° γ=90.00°

Acemetacin monohydrate

C₂₁H₁₈ClNO_6,H₂O

Gelbrich, Thomas Haddow, Mairi F.Griesser, Ulrich J.

Acta Crystallographica Section C (2007) 63, 8 o451-o453

a=7.7257(3)Å b=10.2208(3)Å c=13.4225(4)Å

α=96.879(2)° β=96.354(2)° γ=107.158(2)°

Butobarbital

C₁₀H₁₆N₂O₃

Gelbrich, Thomas Zencirci, Neslihan Griesser, Ulrich J.

Acta Crystallographica Section C (2007) 63, 12 o751-o753

a=6.85340(10)Å b=29.6631(7)Å c=22.2107(5)Å

α=90.00° β=94.4080(10)° γ=90.00°

Plumeridoid C

C₁₅H₁₈O₇

Waltenberger, Birgit Rollinger, Judith M.Griesser, Ulrich J.Stuppner, Hermann Gelbrich, Thomas

Acta Crystallographica Section C (2011) 67, 10 o409-o412

a=9.6736(2)Å b=7.62030(10)Å c=10.6303(2)Å

α=90.00° β=107.142(2)° γ=90.00°

Eldoral

C₁₁H₁₇N₃O₃

Gelbrich, Thomas Rossi, Denise Griesser, Ulrich J.

Acta Crystallographica Section C (2012) 68, 2 o65-o70

a=7.8761(2)Å b=12.7102(4)Å c=11.9438(3)Å

α=90.00° β=98.189(3)° γ=90.00°

Eldoral

C₁₁H₁₇N₃O₃

Gelbrich, Thomas Rossi, Denise Griesser, Ulrich J.

Acta Crystallographica Section C (2012) 68, 2 o65-o70

a=11.9311(3)Å b=15.9858(4)Å c=13.0768(3)Å

α=90.00° β=106.7990(10)° γ=90.00°

Diethylammonium 5-ethyl-2,4,6-trioxo-5-(piperidin-1-yl)-1,3-diazinan-1-ide

C₄H₁₂N_,C₁₁H₁₆N₃O₃

Gelbrich, Thomas Rossi, Denise Griesser, Ulrich J.

Acta Crystallographica Section C (2012) 68, 2 o65-o70

a=11.8270(3)Å b=16.1719(4)Å c=18.6774(5)Å

α=90.00° β=90.00° γ=90.00°

Diphenylmethanesulfonamide

C₁₃H₁₄N₂O₄S₂

Gelbrich, Thomas Haddow, Mairi F.Griesser, Ulrich J.

Acta Crystallographica Section E (2010) 66, 7 o1619

a=10.8251(5)Å b=5.0791(3)Å c=12.6912(5)Å

α=90° β=90.931(3)° γ=90°

Polythiazide

C₁₁H₁₃ClF₃N₃O₄S₃

Gelbrich, Thomas Haddow, Mairi F.Griesser, Ulrich J.

Acta Crystallographica Section E (2010) 66, 7 o1663-o1664

a=14.6659(7)Å b=9.5498(6)Å c=13.6720(7)Å

α=90.00° β=116.149(3)° γ=90.00°

Butallylonal 1,4-dioxane hemisolvate

C₁₁H₁₅BrN₂O_3,0.5(C₄H₈O₂)

Gelbrich, Thomas Rossi, Denise Griesser, Ulrich J.

Acta Crystallographica Section E (2010) 66, 10 o2688

a=10.494(2)Å b=6.7679(8)Å c=21.864(3)Å

α=90.00° β=97.294(15)° γ=90.00°

5,5-dihydroxybarbituric acid 1,4-dioxane hemisolvate

C₄H₄N₂O_5,0.5(C₄H₈O₂)

Gelbrich, Thomas Rossi, Denise Griesser, Ulrich J.

Acta Crystallographica Section E (2010) 66, 5 o1219

a=6.0232(3)Å b=8.3954(4)Å c=8.6858(5)Å

α=106.007(4)° β=94.459(3)° γ=110.126(3)°

Proseptazine

C₁₃H₁₄N₂O₂S

Gelbrich, Thomas Haddow, Mairi F.Griesser, Ulrich J.

Acta Crystallographica Section E (2011) 67, 6 o1551-o1552

a=7.84260(10)Å b=10.5549(11)Å c=14.6694(3)Å

α=90.00° β=90.00° γ=90.00°

Morphine

C₁₇H₁₉NO₃

Gelbrich, Thomas Braun, Doris E.Griesser, Ulrich J.

Acta Crystallographica Section E (2013) 69, 1 o2

a=7.6989(10)Å b=12.737(4)Å c=13.740(4)Å

α=90.00° β=90.00° γ=90.00°

Gliquidone

C₂₇H₃₃N₃O₆S

Gelbrich, Thomas Haddow, Mairi F.Griesser, Ulrich J.

Acta Crystallographica Section E (2011) 67, 6 o1343

a=19.1494(4)Å b=10.7253(3)Å c=13.8024(2)Å

α=90.00° β=106.6910(10)° γ=90.00°

5,5-dichlorobarbituric acid

C₄H₂Cl₂N₂O₃

Gelbrich, Thomas Rossi, Denise Griesser, Ulrich J.

Acta Crystallographica Section E (2012) 68, 1 o235-o236

a=13.8883(3)Å b=13.8883(3)Å c=6.9126(2)Å

α=90.00° β=90.00° γ=90.00°

Morphine hydrochloride anhydrate

C₁₇H₂₀NO_3,Cl

Gelbrich, Thomas Braun, Doris E.Griesser, Ulrich J.

Acta Crystallographica Section E (2012) 68, 12 o3358-o3359

a=7.3504(2)Å b=12.8524(5)Å c=16.0372(5)Å

α=90.00° β=90.00° γ=90.00°

Creatine anhydrate B

C₄H₉N₃O₂

Braun, Doris E.Orlova, Maria Griesser, Ulrich J.

Crystal Growth & Design (2014) 14, 10 4895

a=5.4857(3)Å b=11.4417(4)Å c=9.9624(5)Å

α=90.00000° β=98.663(5)° γ=90.00000°

Creatine anhydrate form C

C₄H₉N₃O₂

Braun, Doris E.Orlova, Maria Griesser, Ulrich J.

Crystal Growth & Design (2014) 14, 10 4895

a=11.9504(3)Å b=5.3453(2)Å c=9.5314(3)Å

α=90.00000° β=90.00000° γ=90.00000°

C₁₈H₂₆BF₄Fe

Herwig Schottenberger Klaus Wurst Ulrich J. Griesser Ram K. R. Jetti Gerhard Laus Rolfe H. Herber Israel Nowik

Journal of the American Chemical Society (2005) 127, 6795-6801

a=13.6067(9)Å b=8.1374(4)Å c=17.5031(9)Å

α=90.00° β=109.835(3)° γ=90.00°

α-indomethacin

C₁₉H₁₆ClNO₄

Xiaoming Chen Kenneth R. Morris Ulrich J. Griesser Stephen R. Byrn Joseph G. Stowell

Journal of the American Chemical Society (2002) 124, 50 15012-15019

a=5.4616(16)Å b=25.310(9)Å c=18.152(7)Å

α=90.00° β=94.38(3)° γ=90.00°

Beta resoryclic acid form I

C₇H₆O₄

Braun, Doris E.Karamertzanis, Panagiotis G.Arlin, Jean-Baptiste Florence, Alastair J.Kahlenberg, Volker Tocher, Derek A.Griesser, Ulrich J.Price, Sarah L.

Crystal growth & design (2011) 11, 1 210-220

a=23.1978(4)Å b=5.5469(1)Å c=5.1980(1)Å

α=90° β=92.215(1)° γ=90°

Beta resoryclic acid hemihydrate

2(C₇H₆O₄)_,H₂O

Braun, Doris E.Karamertzanis, Panagiotis G.Arlin, Jean-Baptiste Florence, Alastair J.Kahlenberg, Volker Tocher, Derek A.Griesser, Ulrich J.Price, Sarah L.

Crystal growth & design (2011) 11, 1 210-220

a=7.0270(4)Å b=9.5449(4)Å c=11.1763(5)Å

α=96.684(4)° β=104.319(5)° γ=98.903(4)°

Beta resoryclic DMSO hemisolvate

2(C₇H₆O₄)_,C₂H₆OS

Braun, Doris E.Karamertzanis, Panagiotis G.Arlin, Jean-Baptiste Florence, Alastair J.Kahlenberg, Volker Tocher, Derek A.Griesser, Ulrich J.Price, Sarah L.

Crystal growth & design (2011) 11, 1 210-220

a=6.39832(12)Å b=11.7099(3)Å c=23.2362(5)Å

α=90° β=90° γ=90°

Beta resoryclate pyridinium salt

C₇H₅O_4,C₅H₆N

Braun, Doris E.Karamertzanis, Panagiotis G.Arlin, Jean-Baptiste Florence, Alastair J.Kahlenberg, Volker Tocher, Derek A.Griesser, Ulrich J.Price, Sarah L.

Crystal growth & design (2011) 11, 1 210-220

a=11.7363(4)Å b=8.5691(2)Å c=11.8310(4)Å

α=90° β=115.973(5)° γ=90°

4-amino-1,2,4-triazole hydrochloride

C₂H₅ClN₄

Laus, G.Kahlenberg, V.Többens, D. M.Jetti, R. K. R.Griesser, U. J.Schütz, J.Kristeva, E.Wurst, K.Schottenberger, H.

Crystal Growth & Design (2006) 6, 2 404

a=7.1584(14)Å b=8.1640(16)Å c=9.3954(19)Å

α=90.00° β=102.97(3)° γ=90.00°

1-aminoimidazole hydrochloride

C₃H₆ClN₃

Laus, G.Kahlenberg, V.Többens, D. M.Jetti, R. K. R.Griesser, U. J.Schütz, J.Kristeva, E.Wurst, K.Schottenberger, H.

Crystal Growth & Design (2006) 6, 2 404

a=9.3559(19)Å b=4.9432(10)Å c=12.182(2)Å

α=90.00° β=97.76(3)° γ=90.00°