Structures published

Total: 143

4.001(H₂N_0.5)_,0.5(B₁₂H₁₂)

Kleemiss, Florian Dolomanov, Oleg V.Bodensteiner, Michael Peyerimhoff, Norbert Midgley, Laura Bourhis, Luc J.Genoni, Alessandro Malaspina, Lorraine A.Jayatilaka, Dylan Spencer, John L.White, Fraser Grundkötter-Stock, Bernhard Steinhauer, Simon Lentz, Dieter Puschmann, Horst Grabowsky, Simon

Chemical Science (2021)

a=9.10295(12)Å b=9.10295(12)Å c=9.10295(12)Å

α=90° β=90° γ=90°

Ca₁F₂

Chemical Science (2021)

a=5.45095(5)Å b=5.45095(5)Å c=5.45095(5)Å

α=90° β=90° γ=90°

C₃H₇NO₂

Chemical Science (2021)

a=5.9279(10)Å b=12.2597(17)Å c=5.7939(9)Å

α=90° β=90° γ=90°

C₆H₆O_2,C_0.286O_0.57

Chemical Science (2021)

a=16.2023(11)Å b=16.2023(11)Å c=5.6943(4)Å

α=90° β=90° γ=120°

Glycil-L-Alanine

C₅H₁₀N₂O₃

Chemical Science (2021)

a=7.4583(4)Å b=9.4892(7)Å c=9.7301(6)Å

α=90° β=90° γ=90°

C₁₀H₁₀F₂N₄

Chemical Science (2021)

a=6.9196(1)Å b=14.5749(2)Å c=9.7248(1)Å

α=90° β=90.637(1)° γ=90°

C₂₄H₄₄OsP₂

Chemical Science (2021)

a=10.8918(1)Å b=13.7619(1)Å c=17.0714(2)Å

α=90° β=98.563(1)° γ=90°

Ibuprofen

C₁₃H₁₈O₂

Kleemiss, Florian Justies, Aileen Duvinage, Daniel Watermann, Patrick Ehrke, Eric Sugimoto, Kunihisa Fugel, Malte Malaspina, Lorraine A.Dittmer, Anneke Kleemiss, Torsten Puylaert, Pim King, Nelly R.Staubitz, Anne Tzschentke, Thomas M.Dringen, Ralf Grabowsky, Simon Beckmann, Jens

Journal of medicinal chemistry (2020)

a=14.465(3)Å b=7.8150(16)Å c=10.435(2)Å

α=90.000000(0)° β=99.66(3)° γ=90.000000(0)°

Sila-ibuprofen

C₁₂H₁₈O₂Si₁

Journal of medicinal chemistry (2020)

a=14.814(3)Å b=7.9720(16)Å c=10.798(2)Å

α=90.000000(0)° β=100.70(3)° γ=90.000000(0)°

C₂₃H₄₃N₃O₆

Pal, Rumpa Reddy, M. B. Madhusudana Dinesh, B.Venkatesha, Manjunath A.Grabowsky, Simon Jelsch, Christian Guru Row, Tayur N.

The journal of physical chemistry. A (2018) 122, 14 3665-3679

a=9.42370(10)Å b=15.9868(2)Å c=17.3878(2)Å

α=90.° β=90.° γ=90.°

C₂₅H₄₇N₃O₆

Pal, Rumpa Reddy, M. B. Madhusudana Dinesh, B.Venkatesha, Manjunath A.Grabowsky, Simon Jelsch, Christian Guru Row, Tayur N.

The journal of physical chemistry. A (2018) 122, 14 3665-3679

a=10.2236(11)Å b=12.3246(10)Å c=12.3403(14)Å

α=90° β=109.388(12)° γ=90°

C₁₉H₃₆N₂O₅

Pal, Rumpa Reddy, M. B. Madhusudana Dinesh, B.Venkatesha, Manjunath A.Grabowsky, Simon Jelsch, Christian Guru Row, Tayur N.

The journal of physical chemistry. A (2018) 122, 14 3665-3679

a=5.2149(6)Å b=15.0953(11)Å c=27.017(3)Å

α=90° β=90° γ=90°

C₃₂H₆₂N₄O₈

Pal, Rumpa Reddy, M. B. Madhusudana Dinesh, B.Venkatesha, Manjunath A.Grabowsky, Simon Jelsch, Christian Guru Row, Tayur N.

The journal of physical chemistry. A (2018) 122, 14 3665-3679

a=10.3122(10)Å b=10.9803(19)Å c=16.8121(19)Å

α=90° β=106.622(11)° γ=90°

C₃₄H₆₄N₄O₁₀

Pal, Rumpa Reddy, M. B. Madhusudana Dinesh, B.Venkatesha, Manjunath A.Grabowsky, Simon Jelsch, Christian Guru Row, Tayur N.

The journal of physical chemistry. A (2018) 122, 14 3665-3679

a=9.8681(14)Å b=17.500(2)Å c=12.2922(12)Å

α=90° β=102.706(11)° γ=90°

Triphenyl bismuth

C₁₈H₁₅Bi

Bučinský, Lukáš Jayatilaka, Dylan Grabowsky, Simon

The journal of physical chemistry. A (2016) 120, 33 6650-6669

a=26.5617(7)Å b=5.70760(10)Å c=20.2096(6)Å

α=90.00° β=109.720(3)° γ=90.00°

Ammonia Trifluoroborane

BF₃H₃N

Mebs, Stefan Grabowsky, Simon Förster, Diana Kickbusch, Rainer Hartl, Monika Daemen, Luke L.Morgenroth, Wolfgang Luger, Peter Paulus, Beate Lentz, Dieter

The journal of physical chemistry. A (2010) 114, 37 10185-10196

a=8.0067(8)Å b=7.9511(8)Å c=9.2216(9)Å

α=90.00° β=90.00° γ=90.00°

Hydrazineborane

BH₇N₂

Mebs, Stefan Grabowsky, Simon Förster, Diana Kickbusch, Rainer Hartl, Monika Daemen, Luke L.Morgenroth, Wolfgang Luger, Peter Paulus, Beate Lentz, Dieter

The journal of physical chemistry. A (2010) 114, 37 10185-10196

a=12.974(2)Å b=5.0702(10)Å c=9.5069(10)Å

α=90.00° β=90.00° γ=90.00°

8-hydroxyquinolinium hydrogen maleate

C₉H₈NO_,C₄H₃O₄

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=5.33860(10)Å b=9.9878(2)Å c=22.3493(4)Å

α=90° β=90° γ=90°

Potassium hydrogen maleate

C₄H₃O_4,K

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=4.50760(10)Å b=7.70270(10)Å c=15.9229(3)Å

α=90° β=90° γ=90°

Lithium hydrogen maleate dihydrate

C₄H₃O_4,Li_,2(H₂O)

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=5.83310(10)Å b=5.94390(10)Å c=18.7920(4)Å

α=90° β=91.3050(10)° γ=90°

Sodium hydrogen maleate trihydrate

C₄H₃O_4,Na_,3(H₂O)

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=5.9224(4)Å b=6.2512(3)Å c=11.2141(7)Å

α=103.935(7)° β=91.490(6)° γ=99.823(7)°

4-aminopyridinium hydrogen maleate

C₄H₃O_4,C₅H₇N₂

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=7.85280(10)Å b=5.54510(10)Å c=10.9223(2)Å

α=90° β=96.394(7)° γ=90°

Magnesium bis(hydrogen maleate) hexahydrate

2(C₄H₃O₄)_,Mg_,6(H₂O)

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=10.195(2)Å b=11.759(2)Å c=6.6206(13)Å

α=90° β=103.67(3)° γ=90°

Substituted aziridine

C₁₂H₁₂N₂O₆

Grabowsky, Simon Pfeuffer, Thomas Morgenroth, Wolfgang Paulmann, Carsten Schirmeister, Tanja Luger, Peter

Organic & Biomolecular Chemistry (2008) 6, 13 2295-2307

a=8.013(2)Å b=13.312(3)Å c=13.652(2)Å

α=105.984(7)° β=106.137(12)° γ=107.137(9)°

Acceptor-substituted oxirane

C₁₂H₁₁NO₇

Grabowsky, Simon Pfeuffer, Thomas Morgenroth, Wolfgang Paulmann, Carsten Schirmeister, Tanja Luger, Peter

Organic & Biomolecular Chemistry (2008) 6, 13 2295-2307

a=7.746(1)Å b=8.080(1)Å c=11.835(1)Å

α=86.198(1)° β=74.105(1)° γ=60.673(1)°

Acceptor-substituted aziridine

C₁₂H₁₂N₂O₆

Grabowsky, Simon Pfeuffer, Thomas Morgenroth, Wolfgang Paulmann, Carsten Schirmeister, Tanja Luger, Peter

Organic & Biomolecular Chemistry (2008) 6, 13 2295-2307

a=8.0274(16)Å b=13.333(3)Å c=13.674(3)Å

α=105.97(3)° β=106.05(3)° γ=107.14(3)°

Acceptor-substituted olefin

C₁₂H₁₁NO₆

Grabowsky, Simon Pfeuffer, Thomas Morgenroth, Wolfgang Paulmann, Carsten Schirmeister, Tanja Luger, Peter

Organic & Biomolecular Chemistry (2008) 6, 13 2295-2307

a=7.769(2)Å b=7.865(1)Å c=10.811(1)Å

α=87.61(2)° β=85.41(4)° γ=62.43(1)°

C₂₀H₂₂FNSi

Fugel, Malte Ponomarenko, Maksym Hesse, Maxie F.Malaspina, Lorraine Andrade Kleemiss, Florian Sugimoto, Kunihisa Genoni, Alessandro Röschenthaler, Gerd-Volker Grabowsky, Simon

Dalton Transactions (2019)

a=7.5718(3)Å b=17.2362(6)Å c=13.0930(5)Å

α=90.00° β=95.9760(10)° γ=90.00°

C₁₉H₂₀FNSi

Fugel, Malte Ponomarenko, Maksym Hesse, Maxie F.Malaspina, Lorraine Andrade Kleemiss, Florian Sugimoto, Kunihisa Genoni, Alessandro Röschenthaler, Gerd-Volker Grabowsky, Simon

Dalton Transactions (2019)

a=9.5986(19)Å b=11.430(2)Å c=29.056(6)Å

α=90.00° β=90.00° γ=90.00°

2(C₂₀H₂₃FNSi)_,2(BF₄)_,CH₂Cl₂

Fugel, Malte Ponomarenko, Maksym Hesse, Maxie F.Malaspina, Lorraine Andrade Kleemiss, Florian Sugimoto, Kunihisa Genoni, Alessandro Röschenthaler, Gerd-Volker Grabowsky, Simon

Dalton Transactions (2019)

a=13.131(3)Å b=7.7980(16)Å c=21.291(4)Å

α=90° β=99.58(3)° γ=90°

Bis-(tetraphenylphosphonium)-dodecacyano-closo-dodecaborate

2(C₂₄H₂₀P)_,B₁₂C_11.56I_0.44N_11.56

Mayer, Martin Rohdenburg, Markus van Lessen, Valentin Nierstenhöfer, Marc C Aprà, Edoardo Grabowsky, Simon Asmis, Knut R.Jenne, Carsten Warneke, Jonas

Chemical communications (Cambridge, England) (2020) 56, 33 4591-4594

a=14.8599(7)Å b=14.7377(6)Å c=15.2073(7)Å

α=90° β=109.961(6)° γ=90°

Loxistatinic acid (E64c)

C₁₅H₂₆N₂O₅

Shi, Ming W.Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Schmidt, Thomas C.Luger, Peter Mebs, Stefan Dittrich, Birger Chen, Yu-Sheng Bąk, Joanna M.Jayatilaka, Dylan Bond, Charles S.Turner, Michael J.Stewart, Scott G.Spackman, Mark A.Grabowsky, Simon

New J. Chem. (2015) 39, 3 1628

a=10.036(2)Å b=11.838(2)Å c=15.884(3)Å

α=79.36(3)° β=78.98(3)° γ=74.71(3)°

C₁₇H₁₆N₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=8.4275(2)Å b=16.8324(4)Å c=11.6886(2)Å

α=90.0° β=97.869(2)° γ=90.0°

C₁₇H₁₆N₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=29.3586(16)Å b=5.6119(2)Å c=24.1160(15)Å

α=90.0° β=122.985(8)° γ=90.0°

C₁₆H₁₃FN₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=8.3288(2)Å b=11.2945(2)Å c=17.1609(4)Å

α=90.0° β=100.643(2)° γ=90.0°

C₁₆H₁₃N₃O₄S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=11.226(2)Å b=10.807(2)Å c=14.909(3)Å

α=90.00° β=110.24(3)° γ=90.00°

C₁₇H₁₆N₂O₃S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=8.6156(2)Å b=20.5840(4)Å c=9.6518(2)Å

α=90.0° β=101.108(2)° γ=90.0°

Sulphonly compound

C₁₁H₁₂N₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=7.9295(16)Å b=11.306(2)Å c=14.113(3)Å

α=90.00° β=99.94(3)° γ=90.00°

C₁₂H₁₄N₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=8.0971(1)Å b=12.4447(2)Å c=13.3768(3)Å

α=87.181(2)° β=80.232(1)° γ=88.150(1)°

C₁₆H₁₄N₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=11.0502(3)Å b=11.5540(4)Å c=13.7697(4)Å

α=66.109(3)° β=84.184(2)° γ=77.048(2)°

C₈H₁₂AgN_4,F₆P

Bąk, Joanna M.Effendy,Grabowsky, Simon Lindoy, Leonard F.Price, Jason R.Skelton, Brian W.White, Allan H.

CrystEngComm (2013) 15, 6 1125

a=8.5321(4)Å b=20.7094(10)Å c=25.7690(10)Å

α=90° β=90° γ=90°

C₈H₁₂CuN_4,F₆P_,C₂H₃N

Bąk, Joanna M.Effendy,Grabowsky, Simon Lindoy, Leonard F.Price, Jason R.Skelton, Brian W.White, Allan H.

CrystEngComm (2013) 15, 6 1125

a=8.57130(10)Å b=21.9018(3)Å c=27.8052(5)Å

α=90° β=90° γ=90°

C₈H₁₂AgN_4,ClO₄

Bąk, Joanna M.Effendy,Grabowsky, Simon Lindoy, Leonard F.Price, Jason R.Skelton, Brian W.White, Allan H.

CrystEngComm (2013) 15, 6 1125

a=24.2440(10)Å b=8.5678(5)Å c=20.6540(10)Å

α=90° β=90° γ=90°

C₁₇H₁₆O₅

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=10.6142(2)Å b=5.8945(1)Å c=11.1109(2)Å

α=90.0° β=90.093(2)° γ=90.0°

C₁₅H₁₄O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=22.438(1)Å b=7.1267(2)Å c=16.9373(7)Å

α=90.0° β=117.532(6)° γ=90.0°

C₁₆H₁₆O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=11.8830(2)Å b=14.6412(3)Å c=15.4699(3)Å

α=90.0° β=108.565(2)° γ=90.0°

C₁₂H₈O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=20.0779(8)Å b=6.2280(3)Å c=7.2121(3)Å

α=90.0° β=100.161(4)° γ=90.0°

C₁₇H₁₆O₅

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=6.5117(1)Å b=10.3653(2)Å c=21.8661(4)Å

α=90.0° β=90.0° γ=90.0°

C₁₆H₁₆O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=8.1408(2)Å b=10.6093(2)Å c=15.5627(3)Å

α=90.0° β=95.408(2)° γ=90.0°

C₁₄H₁₂O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=7.5217(2)Å b=15.7302(4)Å c=9.0870(2)Å

α=90.0° β=90.0° γ=90.0°

C₁₃H₇Cl₃O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=5.8452(3)Å b=9.3279(3)Å c=12.1599(6)Å

α=109.289(4)° β=99.692(4)° γ=93.069(4)°

C₁₅H₁₄O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=7.8319(2)Å b=12.3938(5)Å c=24.6888(7)Å

α=90.0° β=90.0° γ=90.0°

C₁₃H₁₀O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=10.7746(4)Å b=15.6168(5)Å c=6.1107(2)Å

α=90.0° β=98.201(3)° γ=90.0°

L-phenylalaninium hydrogen maleate

C₄H₃O_4,C₉H₁₂NO₂

Malaspina, Lorraine Andrade Hoser, Anna A.Edwards, Alison Woinska, Magdalena Turner, Michael J.Price, Jason R.Sugimoto, Kunihisa Nishibori, Eiji Burgi, Hans-Beat Jayatilaka, Dylan Grabowsky, Simon

CrystEngComm (2020)

a=10.905(2)Å b=5.2338(10)Å c=11.439(2)Å

α=90° β=101.36(3)° γ=90°

C₁₆H₁₃IN₂O₂S₂

Schneider, Thomas H.Rieger, Max Ansorg, Kay Sobolev, Alexandre N.Schirmeister, Tanja Engels, Bernd Grabowsky, Simon

New J. Chem. (2015)

a=28.3814(8)Å b=6.2777(1)Å c=21.5020(7)Å

α=90.0° β=117.043(4)° γ=90.0°

C₁₄H₁₂O₃

Grabowsky, Simon Dean, Pamela M.Skelton, Brian W.Sobolev, Alexandre N.Spackman, Mark A.White, Allan H.

CrystEngComm (2012) 14, 3 1083

a=9.0829(2)Å b=8.4907(2)Å c=14.0688(3)Å

α=90.0° β=96.172(2)° γ=90.0°

2,2'-Bipyridinium picrate mono-acetonitrile solvate

C₆H₂N₃O_7,C₁₀H₉N_2,C₂H₃N

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=3.7068(10)Å b=13.382(3)Å c=18.423(5)Å

α=98.732(4)° β=93.699(4)° γ=95.739(4)°

Morpholinium picrate hemihydrate

2(C₆H₂N₃O₇)_,2(C₄H₁₀NO)_,H₂O

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=17.8023(10)Å b=15.2063(9)Å c=20.3551(12)Å

α=90.00° β=102.3310(10)° γ=90.00°

1,10-Phenanthrolinium picrate

C₆H₂N₃O_7,C₁₂H₉N₂

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=13.509(5)Å b=7.028(3)Å c=18.804(7)Å

α=90.00° β=98.116(6)° γ=90.00°

2,2':6',2''-Terpyridinium picrate

C₁₅H₁₂N_3,C₆H₂N₃O₇

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=8.2700(5)Å b=10.6206(6)Å c=11.4612(7)Å

α=82.1260(10)° β=86.8830(10)° γ=71.8560(10)°

Piperidinium picrate mono-piperidine solvate

C₆H₂N₃O_7,C₅H₁₁N_,C₅H₁₂N

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=6.5862(5)Å b=16.8945(13)Å c=17.1437(14)Å

α=90.00° β=99.306(2)° γ=90.00°

2,9-Dimethyl-1,10-phenanthrolinium picrate

C₆H₂N₃O_7,C₁₄H₁₃N₂

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=8.2754(16)Å b=10.872(2)Å c=11.452(2)Å

α=98.064(4)° β=104.517(3)° γ=102.449(4)°

8-Hydroxyquinolinium picrate

C₆H₂N₃O_7,C₉H₈NO

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=8.259(2)Å b=9.243(2)Å c=19.849(5)Å

α=90.00° β=91.282(4)° γ=90.00°

2-Methylpyridinium picrate

C₆H₂N₃O_7,C₆H₈N

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=8.191(3)Å b=11.869(4)Å c=13.953(5)Å

α=86.255(5)° β=82.754(6)° γ=80.752(5)°

Bis(2-pyridyl)ammonium picrate

C₆H₂N₃O_7,C₁₀H₁₀N₃

Chan, Eric J.Grabowsky, Simon Harrowfield, Jack M.Shi, Ming W.Skelton, Brian W.Sobolev, Alexandre N.White, Allan H.

CrystEngComm (2014) 16, 21 4508

a=9.1996(11)Å b=14.6492(18)Å c=13.1834(16)Å

α=90.00° β=108.918(2)° γ=90.00°

Bergenin

C₁₄H₁₆O_9,H₂O

Dittrich, Birger Weber, Manuela Kalinowski, Roman Grabowsky, Simon Hübschle, Christian B.Luger, Peter

Acta Crystallographica Section B (2009) 65, 6 749-756

a=7.4880(10)Å b=13.9340(10)Å c=14.2750(10)Å

α=90.° β=90.° γ=90.°

C₂₅H₂₄O₁₂P_4,2(CH₄O)

Bulut, Aysun Wörle, Michael Zorlu, Yunus Kirpi, Erdogan Kurt, Huseyin Zubieta, Jon Grabowsky, Simon Beckmann, Jens Yücesan, Gündoğ

Acta Crystallographica Section B (2017) 73, 2 296-303

a=29.093(3)Å b=7.2893(8)Å c=18.672(2)Å

α=90° β=127.610(5)° γ=90°

C₅₅H_38.47Cu_2.24N₆O_15.88P₄V_1.94,2(H₂O)

Bulut, Aysun Wörle, Michael Zorlu, Yunus Kirpi, Erdogan Kurt, Huseyin Zubieta, Jon Grabowsky, Simon Beckmann, Jens Yücesan, Gündoğ

Acta Crystallographica Section B (2017) 73, 2 296-303

a=13.6173(8)Å b=14.3205(9)Å c=15.4896(9)Å

α=77.4902(10)° β=71.7418(10)° γ=76.5041(11)°

3-hydroxy-2-phenyl-2,3-dihydro-isoindol-1-one

C₁₄H₁₁NO₂

Checińska, Lilianna Grabowsky, Simon Małecka, Magdalena Rybarczyk-Pirek, Agnieszka J.Jóźwiak, Andrzej Paulmann, Carsten Luger, Peter

Acta Crystallographica Section B (2011) 67, 6 569-581

a=11.827(2)Å b=7.875(2)Å c=23.504(5)Å

α=90.00° β=90.00° γ=90.00°

(3S)-3-hydroxy-2,3-diphenyl-2,3-dihydro-pyrrolo[3,4-c]pyridine-1-one

C₁₉H₁₄N₂O₂

Checińska, Lilianna Grabowsky, Simon Małecka, Magdalena Rybarczyk-Pirek, Agnieszka J.Jóźwiak, Andrzej Paulmann, Carsten Luger, Peter

Acta Crystallographica Section B (2011) 67, 6 569-581

a=7.875(2)Å b=9.892(2)Å c=18.843(4)Å

α=90.00° β=90.00° γ=90.00°

Epoxide or oxirane

C₂H₄O

Grabowsky, Simon Weber, Manuela Buschmann, Jürgen Luger, Peter

Acta Crystallographica Section B (2008) 64, 3 397-400

a=4.633(5)Å b=8.4000(10)Å c=6.577(3)Å

α=90° β=100.37(6)° γ=90°

Thymidine

C₁₀H₁₄N₂O₅

Hübschle, Christian B.Dittrich, Birger Grabowsky, Simon Messerschmidt, Marc Luger, Peter

Acta Crystallographica Section B (2008) 64, 3 363-374

a=4.8462(19)Å b=13.901(6)Å c=16.316(7)Å

α=90.0° β=90.0° γ=90.0°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.854(3)Å b=9.249(3)Å c=10.144(2)Å

α=90° β=90° γ=90°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.853(4)Å b=9.251(5)Å c=10.145(2)Å

α=90° β=90° γ=90°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.866(7)Å b=9.250(7)Å c=10.149(6)Å

α=90° β=90° γ=90°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.884(6)Å b=9.253(6)Å c=10.155(3)Å

α=90° β=90° γ=90°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.9748(2)Å b=9.2492(2)Å c=10.2103(2)Å

α=90° β=90° γ=90°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.9408(2)Å b=9.2479(2)Å c=10.1875(2)Å

α=90° β=90° γ=90°

C₇H₁₁NO_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.9026(2)Å b=9.2485(2)Å c=10.1662(2)Å

α=90° β=90° γ=90°

L-hydroxyproline monohydrate

C₇H₁₁N₁O_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.854(3)Å b=9.249(3)Å c=10.144(2)Å

α=90° β=90° γ=90°

L-hydroxyproline monohydrate

C₇H₁₁N₁O_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=9.9408(2)Å b=9.2479(2)Å c=10.1875(2)Å

α=90° β=90° γ=90°

L-hydroxyproline monohydrate

C₇H₁₁N₁O_4,H₂O

Lübben, Jens Volkmann, Christian Grabowsky, Simon Edwards, Alison Morgenroth, Wolfgang Fabbiani, Francesca P. A.Sheldrick, George M.Dittrich, Birger

Acta Crystallographica Section A (2014) 70, 4 309-316

a=10.0123(2)Å b=9.2556(2)Å c=10.2441(2)Å

α=90° β=90° γ=90°

L-phenylalaninium hydrogen maleate

C₉H₁₂NO_2,C₄H₃O₄

Woińska, Magdalena Jayatilaka, Dylan Spackman, Mark A.Edwards, Alison J.Dominiak, Paulina M.Woźniak, Krzysztof Nishibori, Eiji Sugimoto, Kunihisa Grabowsky, Simon

Acta Crystallographica Section A (2014) 70, 5 483-498

a=10.905(2)Å b=5.2338(10)Å c=11.439(2)Å

α=90° β=101.36(3)° γ=90°

L-phenylalaninium hydrogen maleate

C₉H₁₂NO_2,C₄H₃O₄

Woińska, Magdalena Jayatilaka, Dylan Spackman, Mark A.Edwards, Alison J.Dominiak, Paulina M.Woźniak, Krzysztof Nishibori, Eiji Sugimoto, Kunihisa Grabowsky, Simon

Acta Crystallographica Section A (2014) 70, 5 483-498

a=10.905(2)Å b=5.2338(10)Å c=11.439(2)Å

α=90° β=101.36(3)° γ=90°

Sodium hydrogen maleate

C₄H₃O_4,NaO₃H₆

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=5.9390(12)Å b=6.2687(13)Å c=11.247(2)Å

α=103.95(3)° β=91.49(3)° γ=99.82(3)°

8-hydroxyquinolinium hydrogen maleate

C₉H₈NO_,C₄H₃O₄

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=5.3526(11)Å b=10.014(2)Å c=22.411(4)Å

α=90° β=90° γ=90°

Potassium hydrogen maleate

C₄H₃O_4,K

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=4.5071(9)Å b=7.7017(15)Å c=15.921(3)Å

α=90° β=90° γ=90°

Barium hydrogen maleate

4(C₄O₄H₃)_,Ba_2,8(O₁H₂)

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=6.4162(13)Å b=19.016(4)Å c=11.412(2)Å

α=90° β=92.90(3)° γ=90°

Magnesium hydrogen maleate

2(C₄H₃O₄)_,H₁₂MgO₆

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=10.192(2)Å b=11.756(2)Å c=6.6189(13)Å

α=90° β=103.66(3)° γ=90°

Calcium hydrogen maleate

C₈H₆O_8,Ca_,O₅H₁₀

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=11.724(2)Å b=19.637(4)Å c=6.3269(13)Å

α=90° β=90° γ=90°

4-aminopyridinium hydrogen maleate

C₄H₃O_4,C₅H₇N₂

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=7.8515(16)Å b=5.5447(11)Å c=10.921(2)Å

α=90° β=96.39(3)° γ=90°

Lithium hydrogen maleate

C₄H₃O_4,O₂H₄Li

Malaspina, Lorraine A.Edwards, Alison J.Woińska, Magdalena Jayatilaka, Dylan Turner, Michael J.Price, Jason R.Herbst-Irmer, Regine Sugimoto, Kunihisa Nishibori, Eiji Grabowsky, Simon

Crystal Growth & Design (2017) 17, 7 3812

a=5.8334(12)Å b=5.9257(12)Å c=18.803(4)Å

α=90° β=91.30(3)° γ=90°

TPPA

C₁₀₅H₂₄O₃₂P₄

Schütrumpf, Alexandra Kirpi, Erdoğan Bulut, Aysun Morel, Flavien L.Ranocchiari, Marco Lork, Enno Zorlu, Yunus Grabowsky, Simon Yücesan, Gündoğ Beckmann, Jens

Crystal Growth & Design (2015) 15, 10 4925

a=13.197(3)Å b=13.197(3)Å c=7.5613(19)Å

α=90° β=90° γ=90°

C₃₂H₄₈O₁₆P₄Si

Schütrumpf, Alexandra Kirpi, Erdoğan Bulut, Aysun Morel, Flavien L.Ranocchiari, Marco Lork, Enno Zorlu, Yunus Grabowsky, Simon Yücesan, Gündoğ Beckmann, Jens

Crystal Growth & Design (2015) 15, 10 4925

a=17.265(2)Å b=17.265(2)Å c=7.181(2)Å

α=90° β=90° γ=90°

C₄₈H₇₂O₁₂P₄Si

Schütrumpf, Alexandra Kirpi, Erdoğan Bulut, Aysun Morel, Flavien L.Ranocchiari, Marco Lork, Enno Zorlu, Yunus Grabowsky, Simon Yücesan, Gündoğ Beckmann, Jens

Crystal Growth & Design (2015) 15, 10 4925

a=17.481(3)Å b=17.584(7)Å c=19.029(3)Å

α=90° β=113.180(10)° γ=90°

C₁₀H₁₀F₅NO₅S

Ponomarenko, Maksym V.Grabowsky, Simon Pal, Rumpa Röschenthaler, Gerd-Volker Fokin, Andrey A.

The Journal of organic chemistry (2016) 81, 15 6783-6791

a=14.587(3)Å b=6.5046(13)Å c=15.2015(19)Å

α=90° β=116.131(6)° γ=90°

C₁₁H₁₁F₅O₃S

Ponomarenko, Maksym V.Grabowsky, Simon Pal, Rumpa Röschenthaler, Gerd-Volker Fokin, Andrey A.

The Journal of organic chemistry (2016) 81, 15 6783-6791

a=8.4711(2)Å b=8.8607(2)Å c=8.9602(2)Å

α=99.478(1)° β=110.838(1)° γ=95.682(1)°

C₉H₅F₅O₂S

Ponomarenko, Maksym V.Grabowsky, Simon Pal, Rumpa Röschenthaler, Gerd-Volker Fokin, Andrey A.

The Journal of organic chemistry (2016) 81, 15 6783-6791

a=18.9912(6)Å b=9.2127(3)Å c=12.1513(3)Å

α=90° β=113.891(1)° γ=90°

Tetra-cyano epoxide

C₆N₄O

Simon Grabowsky Tanja Schirmeister Carsten Paulmann Thomas Pfeuffer Peter Luger

Journal of Organic Chemistry (2011) 76, 1305-1318

a=9.5860(19)Å b=6.0820(12)Å c=11.994(2)Å

α=90.00° β=110.79(3)° γ=90.00°

Epoxide or oxirane

C₂H₄O

Simon Grabowsky Tanja Schirmeister Carsten Paulmann Thomas Pfeuffer Peter Luger

Journal of Organic Chemistry (2011) 76, 1305-1318

a=4.633(5)Å b=8.400(1)Å c=6.577(3)Å

α=90° β=100.37(6)° γ=90°