Structures published

Total: 58

Bis-(phenyl)borinic acid benzylaminobenzoate

CH₂Cl_2,C₂₆H₂₄BNO₂

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=14.1158(3)Å b=8.9604(2)Å c=18.8756(4)Å

α=90.00° β=90.0788(17)° γ=90.00°

3,4,5-trifluorophenylboroxine

C₁₈H₆B₃F₉O₃

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=12.8358(9)Å b=12.6583(9)Å c=12.8851(9)Å

α=90° β=119.060(2)° γ=90°

Bis(3,4,5-trifluorophenyl)-borinic acid benzylamine-4'-phenylbutanoate

C₂₉H₂₄BF₆NO₂

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=10.0140(3)Å b=11.7859(4)Å c=23.0748(7)Å

α=103.8183(8)° β=98.0649(10)° γ=96.9376(9)°

Di-2-iodophenylboronic B-O-B di-2-phenylacetate

C₂₈H₂₂B₂I₂O₅

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=10.6350(5)Å b=11.4814(5)Å c=12.2457(6)Å

α=83.1389(18)° β=87.0947(19)° γ=64.1817(17)°

Bis-(2-chlorophenyl)borinic acid benzylamine-4-phenylbutanoat

C₂₉H₂₈BCl₂NO₂

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=9.2006(2)Å b=11.4729(4)Å c=13.1121(4)Å

α=101.570(3)° β=99.773(2)° γ=98.085(3)°

3,4,5-Trifluorophenylboroxine -- benzylamine complex

C₂₅H₁₅B₃F₉NO₃

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=10.3720(5)Å b=11.1795(5)Å c=12.3123(6)Å

α=106.5448(14)° β=111.4917(14)° γ=96.8493(15)°

Bis-3,4,5-trifluorophenylborinic acid ethylenediamine complex

C₁₄H₁₃BF₆N₂O_,0.5(CDCl₃)

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=11.7500(5)Å b=11.0269(4)Å c=13.1973(5)Å

α=90° β=97.3307(14)° γ=90°

Bis(3,4,5-trifluorophenyl)-borinic acid benzylaminobenzoat

C₂₆H₁₈BF₆NO₂

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=10.1019(4)Å b=11.7656(5)Å c=19.5670(9)Å

α=90° β=103.6902(15)° γ=90°

3,4,5-trifluorophenylboroxine

C₁₈H₆B₃F₉O₃

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=17.083(4)Å b=13.093(3)Å c=7.990(2)Å

α=90° β=90° γ=90°

Di-2-chlorophenylboronic B-O-B di-2-phenylacetate

C₂₈H₂₂B₂Cl₂O₅

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=10.4296(5)Å b=11.1470(6)Å c=11.7996(6)Å

α=84.748(2)° β=87.958(2)° γ=67.5356(19)°

Phenylboroxine complex with 4 equiv. benzylamine

C₃₂H₃₃B₃N₂O_3,2(C₇H₉N)

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=21.2120(9)Å b=11.2705(5)Å c=18.8494(8)Å

α=90° β=114.8857(16)° γ=90°

phenylboroxine complex with 2 equiv. benzylamine

C₂₅H₂₄B₃NO_3,C₇H₉N

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=11.2396(4)Å b=15.2054(6)Å c=17.9361(7)Å

α=89.7333(16)° β=72.0196(15)° γ=84.3291(17)°

3,4,5-trifluorophenylboroxine

C₁₈H₆B₃F₉O₃

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=12.8086(4)Å b=12.6262(4)Å c=12.8625(5)Å

α=90° β=119.598(2)° γ=90°

C₅₄H₇₈N₄O₇Zn_2,CHCl₃

Buchard, Antoine Jutz, Fabian Kember, Michael R.White, Andrew J. P.Rzepa, Henry S.Williams, Charlotte K.

Macromolecules (2012) 45, 17 6781

a=13.1893(3)Å b=13.8705(4)Å c=17.9020(5)Å

α=76.412(2)° β=85.719(2)° γ=65.550(3)°

C₄₄H₇₄N₄O₇Zn_2,3.25(C₄H₈O)

Buchard, Antoine Jutz, Fabian Kember, Michael R.White, Andrew J. P.Rzepa, Henry S.Williams, Charlotte K.

Macromolecules (2012) 45, 17 6781

a=32.15167(18)Å b=32.15167(18)Å c=12.28484(10)Å

α=90.00° β=90.00° γ=90.00°

C₂₃H₃₁Br

Christopher Braddock, D.Mahtey, Areeb Rzepa, Henry S.White, Andrew J. P.

Chemical communications (Cambridge, England) (2016) 52, 75 11219-11222

a=22.7174(12)Å b=6.5055(3)Å c=25.6670(15)Å

α=90° β=94.802(5)° γ=90°

C₁₇H₂₅BrO

Christopher Braddock, D.Mahtey, Areeb Rzepa, Henry S.White, Andrew J. P.

Chemical communications (Cambridge, England) (2016) 52, 75 11219-11222

a=10.8427(7)Å b=6.8117(4)Å c=21.2550(17)Å

α=90° β=94.932(6)° γ=90°

C₄₈H₄₅Ag₂Cl₂N₁₆O_8.5

De, Senjuti Drew, Michael G. B.Rzepa, Henry S.Datta, Dipankar

New Journal of Chemistry (2008) 32, 11 1831

a=12.6647(8)Å b=14.9762(8)Å c=15.2718(10)Å

α=74.519(5)° β=83.036(5)° γ=68.151(6)°

C₁₄H₁₄ClIS

Asseily, Gabriel A.Davies, Robert P.Rzepa, Henry S.White, Andrew J. P.

New Journal of Chemistry (2005) 29, 2 315

a=6.956(2)Å b=5.6659(10)Å c=18.636(5)Å

α=90.00° β=98.90(2)° γ=90.00°

C₁₄H₁₄BrIS

Asseily, Gabriel A.Davies, Robert P.Rzepa, Henry S.White, Andrew J. P.

New Journal of Chemistry (2005) 29, 2 315

a=7.1678(6)Å b=5.7376(11)Å c=18.5292(18)Å

α=90.00° β=100.495(7)° γ=90.00°

C₁₅H₁₂F₃N_3,0.25(C₄H₁₀O)

Sebest, Filip Casarrubios, Luis Rzepa, Henry S.White, Andrew J. P.Díez-González, Silvia

Green Chemistry (2018) 20, 17 4023

a=5.6803(5)Å b=22.150(2)Å c=23.2022(16)Å

α=90° β=90.281(7)° γ=90°

C₁₅H₁₂F₃N

Sebest, Filip Casarrubios, Luis Rzepa, Henry S.White, Andrew J. P.Díez-González, Silvia

Green Chemistry (2018) 20, 17 4023

a=27.0703(18)Å b=5.7522(4)Å c=8.0156(5)Å

α=90° β=90° γ=90°

C₁₈H₂₃N₃O₄

Sebest, Filip Casarrubios, Luis Rzepa, Henry S.White, Andrew J. P.Díez-González, Silvia

Green Chemistry (2018) 20, 17 4023

a=5.35503(14)Å b=10.1690(2)Å c=32.7300(7)Å

α=90° β=92.720(2)° γ=90°

C₂₃H₂₁NO₂

Sebest, Filip Casarrubios, Luis Rzepa, Henry S.White, Andrew J. P.Díez-González, Silvia

Green Chemistry (2018) 20, 17 4023

a=5.66625(19)Å b=18.3197(5)Å c=17.6253(6)Å

α=90° β=90.314(3)° γ=90°

C₂₁H₁₉N₃O₂

Sebest, Filip Casarrubios, Luis Rzepa, Henry S.White, Andrew J. P.Díez-González, Silvia

Green Chemistry (2018) 20, 17 4023

a=12.8553(5)Å b=5.5968(2)Å c=24.4632(9)Å

α=90° β=92.110(3)° γ=90°

C₁₆AlF₃₆O_4,C₃₀H_17,CH₂Cl₂

Raphael J. F. Berger Matthew J. Fuchter Ingo Krossing Henry S. Rzepa Julia Schaefer Harald Scherer

Chem.Commun. (2014) 50, 5251

a=14.1452(6)Å b=14.4666(5)Å c=14.8725(6)Å

α=80.425(2)° β=63.572(2)° γ=68.429(2)°

C₁₈H₂₃N₃O₂

Sebest, Filip Casarrubios, Luis Rzepa, Henry S.White, Andrew J. P.Díez-González, Silvia

Green Chemistry (2018) 20, 17 4023

a=12.8362(5)Å b=11.1053(4)Å c=11.7668(4)Å

α=90° β=92.584(4)° γ=90°

C₁₈H₁₈O

Arbour, Jannine L Rzepa, Henry S White, Andrew J P Hii, King Kuok Mimi

Chemical communications (Cambridge, England) (2009) 46 7125-7127

a=14.1920(13)Å b=12.8979(13)Å c=7.4178(6)Å

α=90.00° β=90.00° γ=90.00°

C₃₆H₃₆O₂

Arbour, Jannine L Rzepa, Henry S White, Andrew J P Hii, King Kuok Mimi

Chemical communications (Cambridge, England) (2009) 46 7125-7127

a=6.3771(3)Å b=19.8345(8)Å c=23.2868(12)Å

α=90.00° β=97.321(4)° γ=90.00°

N-fluoroacetyl-(S)-phenylalanine

C₁₁H₁₂FNO₃

Banks, John W.Batsanov, Andrei S.Howard, Judith A. K.O’Hagan, David Rzepa, Henry S.Martin-Santamaria, Sonsoles

Journal of the Chemical Society, Perkin Transactions 2 (1999) 11 2409

a=9.366(1)Å b=16.003(2)Å c=7.598(1)Å

α=90.00° β=90.00° γ=90.00°

N-propionyl-(S)-phenylalanine

C₁₂H₁₅NO₃

Banks, John W.Batsanov, Andrei S.Howard, Judith A. K.O’Hagan, David Rzepa, Henry S.Martin-Santamaria, Sonsoles

Journal of the Chemical Society, Perkin Transactions 2 (1999) 11 2409

a=5.754(2)Å b=8.139(2)Å c=24.873(2)Å

α=90.00° β=90.00° γ=90.00°

N-phenyl-2-(S)-fluoropropionamide with ca. 10% of N-phenyl-2-(R)-fluoropropionamide

C₉H₁₀FNO

Banks, John W.Batsanov, Andrei S.Howard, Judith A. K.O’Hagan, David Rzepa, Henry S.Martin-Santamaria, Sonsoles

Journal of the Chemical Society, Perkin Transactions 2 (1999) 11 2409

a=5.367(1)Å b=8.821(4)Å c=9.893(3)Å

α=106.65(2)° β=101.84(2)° γ=105.13(2)°

Bis-3,4,5-trifluorophenylborinic acid benzylamine complex

C₁₉H₁₄BF₆NO

Arkhipenko, Sergey Sabatini, Marco T.Batsanov, Andrei S.Karaluka, Valerija Sheppard, Tom D.Rzepa, Henry S.Whiting, Andrew

Chemical science (2018) 9, 4 1058-1072

a=9.03430(10)Å b=10.2063(2)Å c=11.0348(2)Å

α=66.3381(18)° β=70.1856(17)° γ=78.1262(19)°

C₁₃H₁₇BrClNO₂

Clarke, James Bonney, Karl J.Yaqoob, Muhammad Solanki, Savade Rzepa, Henry S.White, Andrew J. P.Millan, David S.Braddock, D. Christopher

The Journal of organic chemistry (2016) 81, 20 9539-9552

a=8.87379(10)Å b=4.83007(5)Å c=16.63090(14)Å

α=90° β=90.2687(8)° γ=90°

C₁₃H₁₇BrClNO₂

Clarke, James Bonney, Karl J.Yaqoob, Muhammad Solanki, Savade Rzepa, Henry S.White, Andrew J. P.Millan, David S.Braddock, D. Christopher

The Journal of organic chemistry (2016) 81, 20 9539-9552

a=9.90540(9)Å b=16.30560(13)Å c=17.66934(16)Å

α=90.00° β=90.00° γ=90.00°

C₁₇H₂₁NO₆

Alexander M. R. Smith Henry S. Rzepa Andrew J. P. White Denis Billen

Journal of Organic Chemistry (2010) 75, 3085-3096

a=6.34741(7)Å b=10.76431(9)Å c=12.86992(13)Å

α=90.00° β=102.2709(10)° γ=90.00°

C₃₁H₄₇N₃Sn

Andrew P. Dove Vernon C. Gibson Edward L. Marshall Henry S. Rzepa Andrew J. P. White David J. Williams

Journal of the American Chemical Society (2006) 128, 9834-9843

a=8.9672(13)Å b=22.516(2)Å c=15.026(2)Å

α=90.00° β=99.725(15)° γ=90.00°

C₂₀H₂₄N₂OSn

Andrew P. Dove Vernon C. Gibson Edward L. Marshall Henry S. Rzepa Andrew J. P. White David J. Williams

Journal of the American Chemical Society (2006) 128, 9834-9843

a=7.2919(13)Å b=10.6268(9)Å c=25.237(3)Å

α=90.00° β=96.196(8)° γ=90.00°

C₁₉H₁₇Cl₆N₃Sn

Andrew P. Dove Vernon C. Gibson Edward L. Marshall Henry S. Rzepa Andrew J. P. White David J. Williams

Journal of the American Chemical Society (2006) 128, 9834-9843

a=7.4946(10)Å b=15.424(2)Å c=20.758(4)Å

α=90.00° β=93.738(12)° γ=90.00°

C₃₅H₅₂N₂O₃Sn

Andrew P. Dove Vernon C. Gibson Edward L. Marshall Henry S. Rzepa Andrew J. P. White David J. Williams

Journal of the American Chemical Society (2006) 128, 9834-9843

a=11.7495(19)Å b=9.8141(18)Å c=16.5355(19)Å

α=90.00° β=109.008(11)° γ=90.00°

C₉₀H₁₃₈Si₆

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=14.9868(5)Å b=17.1992(6)Å c=17.4782(6)Å

α=73.888(3)° β=83.705(3)° γ=85.808(3)°

C₆₀H₉₂I₆Si_5,1.5(C₆H₁₄)

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=15.1361(4)Å b=15.2175(3)Å c=17.7339(4)Å

α=90.6585(18)° β=103.886(2)° γ=99.861(2)°

C₉₀H₁₃₈Cl₂Si_6,0.5(C₆H₆)

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=33.8021(4)Å b=26.3632(3)Å c=20.2985(2)Å

α=90.00° β=97.7245(10)° γ=90.00°

C₉₀H₁₃₈Cl₄Si_6,C₆H₆

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=14.2467(2)Å b=14.8874(3)Å c=23.7978(4)Å

α=89.4263(14)° β=73.4546(13)° γ=77.4745(15)°

C₉₀H₁₃₈Cl₂Si_6,0.5(C₆H₁₄)

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=20.1594(5)Å b=27.1066(5)Å c=33.2880(7)Å

α=90.00° β=97.8871(19)° γ=90.00°

C₉₀H₁₃₈Cl₂Si_6,0.125(C₆H₁₄)

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=15.8205(4)Å b=23.7240(5)Å c=25.8774(8)Å

α=74.715(2)° β=77.767(3)° γ=78.396(2)°

C₉₀H₁₃₈Cl_1.1Si_6,1.5(C₆H₁₄)

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=22.01215(14)Å b=17.63669(11)Å c=26.02392(17)Å

α=90.00° β=95.7157(6)° γ=90.00°

C₁₂₀H₁₈₄Si_11,1.25(C₆H₁₄)

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=24.30088(11)Å b=31.59551(13)Å c=35.05545(16)Å

α=90.00° β=106.6533(5)° γ=90.00°

C₉H₉N₅

Calbo, Joaquín Weston, Claire E.White, Andrew J. P.Rzepa, Henry S.Contreras-García, Julia Fuchter, Matthew J.

Journal of the American Chemical Society (2017) 139, 3 1261-1274

a=9.2667(6)Å b=10.0686(5)Å c=10.9395(7)Å

α=90° β=111.348(7)° γ=90°

C₁₀H₁₀N₄

Calbo, Joaquín Weston, Claire E.White, Andrew J. P.Rzepa, Henry S.Contreras-García, Julia Fuchter, Matthew J.

Journal of the American Chemical Society (2017) 139, 3 1261-1274

a=10.1175(2)Å b=11.0673(3)Å c=16.8859(4)Å

α=90° β=90° γ=90°

C₅H₇N₃O₂

Calbo, Joaquín Weston, Claire E.White, Andrew J. P.Rzepa, Henry S.Contreras-García, Julia Fuchter, Matthew J.

Journal of the American Chemical Society (2017) 139, 3 1261-1274

a=8.0120(5)Å b=11.4910(6)Å c=7.7899(5)Å

α=90° β=113.418(8)° γ=90°

C₂₁H₂₅Br₂FeN₅

Michaela Grau Jason England Rafael Torres Martin de Rosales Henry S. Rzepa Andrew J. P. White George J. P. Britovsek

Inorganic Chemistry (2013) 52, 11867-11874

a=8.7168(3)Å b=15.3336(6)Å c=16.8358(7)Å

α=85.049(3)° β=89.833(3)° γ=85.877(3)°

C₂₁H₂₅FeN_5,2(CF₃O₃S)

Michaela Grau Jason England Rafael Torres Martin de Rosales Henry S. Rzepa Andrew J. P. White George J. P. Britovsek

Inorganic Chemistry (2013) 52, 11867-11874

a=22.4112(9)Å b=10.5689(2)Å c=15.0745(6)Å

α=90.00° β=129.267(6)° γ=90.00°

C₄₅H₆₉Cl₃Si₃

Kai Abersfelder Adam Russell Henry S. Rzepa Andrew J. P. White Peter R. Haycock David Scheschkewitz

Journal of the American Chemical Society (2012) 134, 16008-16016

a=11.00084(17)Å b=42.3567(6)Å c=20.2297(3)Å

α=90.00° β=90.5529(15)° γ=90.00°

C₂₅H₃₁FeN_7,2(ClO₄)

Michaela Grau Jason England Rafael Torres Martin de Rosales Henry S. Rzepa Andrew J. P. White George J. P. Britovsek

Inorganic Chemistry (2013) 52, 11867-11874

a=18.3004(2)Å b=12.48519(17)Å c=13.43464(16)Å

α=90.00° β=90.6391(11)° γ=90.00°

C₁₅H₂₀Cl₂FeGeN₂O₄

Jana, Anukul Huch, Volker Rzepa, Henry S.Scheschkewitz, David

Organometallics (2015) 34, 11 2130

a=9.8194(3)Å b=12.8753(5)Å c=15.9909(6)Å

α=90.00° β=94.829(2)° γ=90.00°

C₃₀H₄₀Fe₂Ge₂N₄O₈

Jana, Anukul Huch, Volker Rzepa, Henry S.Scheschkewitz, David

Organometallics (2015) 34, 11 2130

a=11.1640(4)Å b=14.6309(5)Å c=21.7358(8)Å

α=90.00° β=90.00° γ=90.00°

C₃₀H₄₀Fe₂Ge₂N₄O₈S_,C₇H₈

Jana, Anukul Huch, Volker Rzepa, Henry S.Scheschkewitz, David

Organometallics (2015) 34, 11 2130

a=11.0226(2)Å b=17.8671(4)Å c=21.7025(4)Å

α=90.00° β=90.00° γ=90.00°