Crystallography Open Database

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1557627 CIFC3.5 H1.5 N0.5 O Ti0.17P a -321.1222; 21.1222; 21.1222
90; 90; 90
9423.6Cao, Jing; Ma, Wenjie; Lyu, Kangjie; Zhuang, Lin; Cong, Hengjiang; Deng, Hexiang
Twist and sliding dynamics between interpenetrated frames in Ti-MOF revealing high proton conductivity
Chemical Science, 2020, 11, 3978-3985
1557628 CIFC H N O TiP a -321.1205; 21.1205; 21.1205
90; 90; 90
9421.3Cao, Jing; Ma, Wenjie; Lyu, Kangjie; Zhuang, Lin; Cong, Hengjiang; Deng, Hexiang
Twist and sliding dynamics between interpenetrated frames in Ti-MOF revealing high proton conductivity
Chemical Science, 2020, 11, 3978-3985
1557633 CIFC26 H10 B Br F15 NP -17.3; 11.867; 15.598
78.16; 80.45; 88.78
1304.1Aramaki, Yoshitaka; Imaizumi, Naoki; Hotta, Mao; Kumagai, Jun; Ooi, Takashi
Exploiting single-electron transfer in Lewis pairs for catalytic bond-forming reactions
Chemical Science, 2020, 11, 4305-4311
1557634 CIFC26 H37 N3 OP 1 21/n 19.6311; 19.6619; 13.541
90; 106.977; 90
2452.5Odella, Emmanuel; Mora, S. Jimena; Wadsworth, Brian L.; Goings, Joshua J.; Gervaldo, Miguel A.; Sereno, Leonides E.; Groy, Thomas L.; Gust, Devens; Moore, Thomas A.; Moore, Gary F.; Hammes-Schiffer, Sharon; Moore, Ana L.
Proton-coupled electron transfer across benzimidazole bridges in bioinspired proton wires
Chemical Science, 2020, 11, 3820-3828
1557635 CIFC73 H76 Cl2 N10 O4C 1 2/c 133.136; 6.8671; 30.967
90; 100.031; 90
6938.8Odella, Emmanuel; Mora, S. Jimena; Wadsworth, Brian L.; Goings, Joshua J.; Gervaldo, Miguel A.; Sereno, Leonides E.; Groy, Thomas L.; Gust, Devens; Moore, Thomas A.; Moore, Gary F.; Hammes-Schiffer, Sharon; Moore, Ana L.
Proton-coupled electron transfer across benzimidazole bridges in bioinspired proton wires
Chemical Science, 2020, 11, 3820-3828
1557636 CIFC21 H27 N3 O12 TbP -110.4608; 10.9006; 12.5293
104.61; 107.84; 97.204
1283.78Anderson, Samantha L.; Tiana, Davide; Ireland, Christopher P.; Capano, Gloria; Fumanal, Maria; Gładysiak, Andrzej; Kampouri, Stavroula; Rahmanudin, Aiman; Guijarro, Néstor; Sivula, Kevin; Stylianou, Kyriakos C.; Smit, Berend
Taking lanthanides out of isolation: tuning the optical properties of metal‒organic frameworks
Chemical Science, 2020, 11, 4164-4170
1557637 CIFC11 H10 N O7 TbP 1 21/n 113.388; 6.6366; 15.567
90; 98.599; 90
1367.6Anderson, Samantha L.; Tiana, Davide; Ireland, Christopher P.; Capano, Gloria; Fumanal, Maria; Gładysiak, Andrzej; Kampouri, Stavroula; Rahmanudin, Aiman; Guijarro, Néstor; Sivula, Kevin; Stylianou, Kyriakos C.; Smit, Berend
Taking lanthanides out of isolation: tuning the optical properties of metal‒organic frameworks
Chemical Science, 2020, 11, 4164-4170
1557638 CIFC15 H11 N O2 S2P 1 21/c 15.9915; 29.952; 7.8574
90; 95.092; 90
1404.5Gao, Wen-Chao; Tian, Jun; Shang, Yu-Zhu; Jiang, Xuefeng
Steric and stereoscopic disulfide construction for cross-linkage via N-dithiophthalimides
Chemical Science, 2020, 11, 3903-3908
1557639 CIFC18 H15 O3 S2P -19.234; 9.723; 10.6174
99.463; 113.869; 105.929
796.06Gao, Wen-Chao; Tian, Jun; Shang, Yu-Zhu; Jiang, Xuefeng
Steric and stereoscopic disulfide construction for cross-linkage via N-dithiophthalimides
Chemical Science, 2020, 11, 3903-3908
1557640 CIFC30 H27 Br O3 S2P 1 21 123.8898; 6.7617; 24.8099
90; 102.215; 90
3916.95Gao, Wen-Chao; Tian, Jun; Shang, Yu-Zhu; Jiang, Xuefeng
Steric and stereoscopic disulfide construction for cross-linkage via N-dithiophthalimides
Chemical Science, 2020, 11, 3903-3908
1557644 CIFC112 H192 In26 Mn4 N32 S51I 41/a :222.436; 22.436; 38.165
90; 90; 90
19211Xue, Chaozhuang; Fan, Xing; Zhang, Jiaxu; Hu, Dandan; Wang, Xiao-Li; Wang, Xiang; Zhou, Rui; Lin, Haiping; Li, Youyong; Li, Dong-Sheng; Wei, Xiao; Zheng, Daoyuan; Yang, Yang; Han, Keli; Wu, Tao
Direct observation of charge transfer between molecular heterojunctions based on inorganic semiconductor clusters
Chemical Science, 2020, 11, 4085-4096
1557645 CIFC112 H192 Fe4 In26 N32 O0 S51I 41/a :222.329; 22.329; 38.059
90; 90; 90
18976Xue, Chaozhuang; Fan, Xing; Zhang, Jiaxu; Hu, Dandan; Wang, Xiao-Li; Wang, Xiang; Zhou, Rui; Lin, Haiping; Li, Youyong; Li, Dong-Sheng; Wei, Xiao; Zheng, Daoyuan; Yang, Yang; Han, Keli; Wu, Tao
Direct observation of charge transfer between molecular heterojunctions based on inorganic semiconductor clusters
Chemical Science, 2020, 11, 4085-4096
1557646 CIFC19 H19 Br O5P -18.9606; 9.9217; 11.8105
72.29; 88.75; 63.972
891.12Zhao, Qiang; Jin, Ji-Kang; Wang, Jie; Zhang, Feng-Lian; Wang, Yi-Feng
Radical α-addition involved electrooxidative [3 + 2] annulation of phenols and electron-deficient alkenes
Chemical Science, 2020, 11, 3909-3913
1557647 CIFC54 H72 Fe3 Ho Li3 O6P 1 21/c 111.3991; 63.596; 13.7285
90; 92.383; 90
9943.7Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557648 CIFC54 H72 Fe3 Gd Li3 O6P 1 21/c 111.3774; 63.872; 13.7293
90; 92.491; 90
9967.6Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557649 CIFC54 H72 Fe3 Li3 O6 YbP 1 21/c 111.4155; 63.489; 13.73
90; 92.17; 90
9943.8Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557650 CIFC60 H84 Fe3 Ho Li3 O6P 1 21/n 111.3389; 13.7172; 36.2329
90; 95.344; 90
5611.1Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557651 CIFC64.38 H58.38 Fe3 Ho Li3 N6.88P 21 21 2121.206; 22.6446; 23.1321
90; 90; 90
11108.1Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557652 CIFC54 H72 Fe3 Li3 Lu O6P 1 21/c 111.4149; 63.246; 13.743
90; 92.282; 90
9914Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557653 CIFC54 H72 Fe3 Li3 O6 TmP 1 21/c 111.4199; 63.606; 13.7467
90; 92.28; 90
9977Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557654 CIFC54 H72 Er Fe3 Li3 O6P 1 21/c 111.4007; 63.598; 13.7293
90; 92.262; 90
9946.8Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557655 CIFC58 H80 Fe3 Li3 Lu O7I 1 a 120.62; 32.856; 25.081
90; 104.923; 90
16419Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557656 CIFC58 H80 Fe3 Li3 O7 YbC 1 c 128.077; 32.756; 20.619
90; 120.475; 90
16343Latendresse, Trevor P.; Vieru, Veacheslav; Upadhyay, Apoorva; Bhuvanesh, Nattamai S.; Chibotaru, Liviu F.; Nippe, Michael
Trends in trigonal prismatic Ln-[1]ferrocenophane complexes and discovery of a Ho3+ single-molecule magnet
Chemical Science, 2020, 11, 3936-3951
1557674 CIFC12 H18 OP -16.2162; 12.5583; 20.7881
92.381; 98.293; 100.115
1577.16Nelson, Ronald; Calvelo, Martín; García-Fandiño, Rebeca; Lledós, Agustí; Ujaque, Gregori; Mascareñas, José L.; López, Fernando
Skeletal diversity in Pt- and Au-catalyzed annulations of allenedienes: dissecting unconventional mechanistic pathways
Chemical Science, 2020, 11, 4209-4220
1557675 CIFC19 H24 N2 O6P 1 21/c 119.54; 8.3364; 11.3992
90; 95.016; 90
1849.7Nelson, Ronald; Calvelo, Martín; García-Fandiño, Rebeca; Lledós, Agustí; Ujaque, Gregori; Mascareñas, José L.; López, Fernando
Skeletal diversity in Pt- and Au-catalyzed annulations of allenedienes: dissecting unconventional mechanistic pathways
Chemical Science, 2020, 11, 4209-4220
1557676 CIFC19 H34 O SiP 1 21/c 123.4244; 6.2336; 13.0105
90; 90.557; 90
1899.68Nelson, Ronald; Calvelo, Martín; García-Fandiño, Rebeca; Lledós, Agustí; Ujaque, Gregori; Mascareñas, José L.; López, Fernando
Skeletal diversity in Pt- and Au-catalyzed annulations of allenedienes: dissecting unconventional mechanistic pathways
Chemical Science, 2020, 11, 4209-4220
1557677 CIFC12 H18 OI 41/a :222.3413; 22.3413; 8.6532
90; 90; 90
4319.1Nelson, Ronald; Calvelo, Martín; García-Fandiño, Rebeca; Lledós, Agustí; Ujaque, Gregori; Mascareñas, José L.; López, Fernando
Skeletal diversity in Pt- and Au-catalyzed annulations of allenedienes: dissecting unconventional mechanistic pathways
Chemical Science, 2020, 11, 4209-4220
1557678 CIFC20 H23 Br O2P n a 2111.4263; 19.625; 15.7208
90; 90; 90
3525.25Nelson, Ronald; Calvelo, Martín; García-Fandiño, Rebeca; Lledós, Agustí; Ujaque, Gregori; Mascareñas, José L.; López, Fernando
Skeletal diversity in Pt- and Au-catalyzed annulations of allenedienes: dissecting unconventional mechanistic pathways
Chemical Science, 2020, 11, 4209-4220
1557679 CIFC62 H114 Fe N4 Na4 Zn4C 1 2/c 127.395; 44.055; 14.5103
90; 100.575; 90
17215Honeyman, Gordon W.; Armstrong, David R.; Clegg, William; Hevia, Eva; Kennedy, Alan R.; McLellan, Ross; Orr, Samantha A.; Parkinson, John A.; Ramsay, Donna L.; Robertson, Stuart D.; Towie, Stephen; Mulvey, Robert E.
A regioselectively 1,1′,3,3′-tetrazincated ferrocene complex displaying core and peripheral reactivity
Chemical Science, 2020, 11, 6510-6520
1557680 CIFC39 H42 N7 Na ZnP 21 21 218.8556; 17.4144; 23.9796
90; 90; 90
3698.01Honeyman, Gordon W.; Armstrong, David R.; Clegg, William; Hevia, Eva; Kennedy, Alan R.; McLellan, Ross; Orr, Samantha A.; Parkinson, John A.; Ramsay, Donna L.; Robertson, Stuart D.; Towie, Stephen; Mulvey, Robert E.
A regioselectively 1,1′,3,3′-tetrazincated ferrocene complex displaying core and peripheral reactivity
Chemical Science, 2020, 11, 6510-6520
1557681 CIFC68 H110 Fe N4 Na4 Zn4P 1 21/c 114.895; 26.966; 18.622
90; 111.871; 90
6941.3Honeyman, Gordon W.; Armstrong, David R.; Clegg, William; Hevia, Eva; Kennedy, Alan R.; McLellan, Ross; Orr, Samantha A.; Parkinson, John A.; Ramsay, Donna L.; Robertson, Stuart D.; Towie, Stephen; Mulvey, Robert E.
A regioselectively 1,1′,3,3′-tetrazincated ferrocene complex displaying core and peripheral reactivity
Chemical Science, 2020, 11, 6510-6520
1557682 CIFC55 H102 Fe N6 Na2 Zn2P -112.9797; 15.0261; 15.9756
99.482; 90.798; 99.459
3028.7Honeyman, Gordon W.; Armstrong, David R.; Clegg, William; Hevia, Eva; Kennedy, Alan R.; McLellan, Ross; Orr, Samantha A.; Parkinson, John A.; Ramsay, Donna L.; Robertson, Stuart D.; Towie, Stephen; Mulvey, Robert E.
A regioselectively 1,1′,3,3′-tetrazincated ferrocene complex displaying core and peripheral reactivity
Chemical Science, 2020, 11, 6510-6520
1557687 CIFC26 H39 F3 N3 O3 SP 1 21/c 111.3959; 8.8582; 26.7626
90; 91.58; 90
2700.58Messelberger, Julian; Grünwald, Annette; Goodner, Stephen J.; Zeilinger, Florian; Pinter, Piermaria; Miehlich, Matthias E.; Heinemann, Frank W.; Hansmann, Max M.; Munz, Dominik
Aromaticity and sterics control whether a cationic olefin radical is resistant to disproportionation
Chemical Science, 2020, 11, 4138-4149
1557688 CIFC26 H39 F3 N3 O3 SP 1 21/n 114.9305; 11.67; 16.4062
90; 109.508; 90
2694.5Messelberger, Julian; Grünwald, Annette; Goodner, Stephen J.; Zeilinger, Florian; Pinter, Piermaria; Miehlich, Matthias E.; Heinemann, Frank W.; Hansmann, Max M.; Munz, Dominik
Aromaticity and sterics control whether a cationic olefin radical is resistant to disproportionation
Chemical Science, 2020, 11, 4138-4149
1557695 CIFC24 H23 N OP 1 21/c 111.129; 9.485; 18.178
90; 90.821; 90
1918.6Liu, Zhengfen; Li, Minyan; Deng, Guogang; Wei, Wanshi; Feng, Ping; Zi, Quanxing; Li, Tiantian; Zhang, Hongbin; Yang, Xiaodong; Walsh, Patrick J.
Transition-metal-free C(sp3)‒H/C(sp3)‒H dehydrogenative coupling of saturated heterocycles with N-benzyl imines
Chemical Science, 2020, 11, 7619-7625
1557696 CIFC25 H26 N2 OP 1 21/c 110.9067; 9.988; 18.4338
90; 94.55; 90
2001.78Liu, Zhengfen; Li, Minyan; Deng, Guogang; Wei, Wanshi; Feng, Ping; Zi, Quanxing; Li, Tiantian; Zhang, Hongbin; Yang, Xiaodong; Walsh, Patrick J.
Transition-metal-free C(sp3)‒H/C(sp3)‒H dehydrogenative coupling of saturated heterocycles with N-benzyl imines
Chemical Science, 2020, 11, 7619-7625
1557708 CIFC19 H19 N O2P 1 21/c 110.8161; 8.4185; 16.7407
90; 97.266; 90
1512.09Zheng, Shuai; Zhang, Shuo-Qing; Saeednia, Borna; Zhou, Jiawang; Anna, Jessica M.; Hong, Xin; Molander, Gary A.
Diastereoselective olefin amidoacylation via photoredox PCET/nickel-dual catalysis: reaction scope and mechanistic insights
Chemical Science, 2020, 11, 4131-4137
1557732 CIFC53 H39 N5 O2 SP -110.3043; 10.5271; 21.1147
88.634; 86.866; 70.331
2153.5Lv, Chunyan; Liu, Wangwang; Luo, Qing; Yi, Haiyan; Yu, Huakang; Yang, Zhongmin; Zou, Bo; Zhang, Yujian
A highly emissive AIE-active luminophore exhibiting deep-red to near-infrared piezochromism and high-quality lasing
Chemical Science, 2020, 11, 4007-4015
1557737 CIFC114 H810 Mo132 N46 O708 S2R -3 :H32.6262; 32.6262; 73.225
90; 90; 120
67503Pow, Robert W.; Xuan, Weimin; Long, De-Liang; Bell, Nicola L.; Cronin, Leroy
Embedding alkenes within an icosahedral inorganic fullerene {(NH4)42[Mo132O372(L)30(H2O)72]} for trapping volatile organics
Chemical Science, 2020, 11, 2388-2393
1557738 CIFC120 H806 Mo132 N48 O676 S3R -3 :H32.3898; 32.3898; 72.8225
90; 90; 120
66162.6Pow, Robert W.; Xuan, Weimin; Long, De-Liang; Bell, Nicola L.; Cronin, Leroy
Embedding alkenes within an icosahedral inorganic fullerene {(NH4)42[Mo132O372(L)30(H2O)72]} for trapping volatile organics
Chemical Science, 2020, 11, 2388-2393
1557739 CIFC120 H926 Mo132 N48 O736 S3R -3 :H32.4465; 32.4465; 72.887
90; 90; 120
66453.3Pow, Robert W.; Xuan, Weimin; Long, De-Liang; Bell, Nicola L.; Cronin, Leroy
Embedding alkenes within an icosahedral inorganic fullerene {(NH4)42[Mo132O372(L)30(H2O)72]} for trapping volatile organics
Chemical Science, 2020, 11, 2388-2393
1557747 CIFC44 H96 Ca2 Cl N6 O36 V12P 1 21/c 110.6954; 29.2218; 28.2691
90; 95.3952; 90
8796.1Greiner, Simon; Schwarz, Benjamin; Ringenberg, Mark; Dürr, Maximilian; Ivanovic-Burmazovic, Ivana; Fichtner, Maximilian; Anjass, Montaha; Streb, Carsten
Redox-inactive ions control the redox-activity of molecular vanadium oxides
Chemical Science, 2020, 11, 4450-4455
1557749 CIFC27 H27 Cl4 F3 N2 PdP 21 21 217.3222; 16.3645; 22.9119
90; 90; 90
2745.4Baek, Doohyun; Ryu, Huijeong; Ryu, Ji Yeon; Lee, Junseong; Stoltz, Brian M.; Hong, Sukwon
Catalytic enantioselective synthesis of tetrasubstituted chromanones via palladium-catalyzed asymmetric conjugate arylation using chiral pyridine-dihydroisoquinoline ligands
Chemical Science, 2020, 11, 4602-4607
1557750 CIFC20 H22 O2C 1 2 123.2747; 6.7781; 10.2443
90; 91.9349; 90
1615.2Baek, Doohyun; Ryu, Huijeong; Ryu, Ji Yeon; Lee, Junseong; Stoltz, Brian M.; Hong, Sukwon
Catalytic enantioselective synthesis of tetrasubstituted chromanones via palladium-catalyzed asymmetric conjugate arylation using chiral pyridine-dihydroisoquinoline ligands
Chemical Science, 2020, 11, 4602-4607
1557760 CIFC6 H11 S3 SbP 1 21/n 17.5797; 9.1057; 27.371
90; 95.218; 90
1881.3Moaven, Shiva; Watson, Brandon T.; Thompson, Shelby B.; Lyons, Veronica J.; Unruh, Daniel K.; Casadonte, Dominick J.; Pappas, Dimitri; Cozzolino, Anthony F.
Self-assembly of reversed bilayer vesicles through pnictogen bonding: water-stable supramolecular nanocontainers for organic solvents
Chemical Science, 2020, 11, 4374-4380
1557761 CIFC71 H53 B Cl2 F20 N2P -113.2446; 13.7731; 20.2266
94.923; 102.959; 114.918
3192.4Dong, Zhaowen; Pezzato, Cristian; Sienkiewicz, Andrzej; Scopelliti, Rosario; Fadaei-Tirani, Farzaneh; Severin, Kay
SET processes in Lewis acid‒base reactions: the tritylation of N-heterocyclic carbenes
Chemical Science, 2020, 11, 7615-7618
1557762 CIFC35 H21 B F20 N2P 1 21 18.40488; 18.0272; 11.0843
90; 91.4773; 90
1678.9Dong, Zhaowen; Pezzato, Cristian; Sienkiewicz, Andrzej; Scopelliti, Rosario; Fadaei-Tirani, Farzaneh; Severin, Kay
SET processes in Lewis acid‒base reactions: the tritylation of N-heterocyclic carbenes
Chemical Science, 2020, 11, 7615-7618
1557763 CIFC52 H39 B Cl2 F20 N2P -112.4784; 12.6328; 17.6483
69.366; 84.7909; 78.9069
2554.12Dong, Zhaowen; Pezzato, Cristian; Sienkiewicz, Andrzej; Scopelliti, Rosario; Fadaei-Tirani, Farzaneh; Severin, Kay
SET processes in Lewis acid‒base reactions: the tritylation of N-heterocyclic carbenes
Chemical Science, 2020, 11, 7615-7618
1557764 CIFC64 H39 B F20 N2P b c a18.0482; 18.05071; 34.8012
90; 90; 90
11337.6Dong, Zhaowen; Pezzato, Cristian; Sienkiewicz, Andrzej; Scopelliti, Rosario; Fadaei-Tirani, Farzaneh; Severin, Kay
SET processes in Lewis acid‒base reactions: the tritylation of N-heterocyclic carbenes
Chemical Science, 2020, 11, 7615-7618
1557765 CIFC12 Bi2 N12 S12 Zn3C 1 2/c 126.3104; 8.4587; 15.7403
90; 93.63; 90
3496Cliffe, Matthew J.; Keyzer, Evan N.; Bond, Andrew D.; Astle, Maxwell A.; Grey, Clare P.
The structures of ordered defects in thiocyanate analogues of Prussian Blue
Chemical Science, 2020, 11, 4430-4438
1557766 CIFC12 Bi2 N12 S12 Zn3P 1 21/c 117.7331; 13.6501; 16.4375
90; 114.397; 90
3623.55Cliffe, Matthew J.; Keyzer, Evan N.; Bond, Andrew D.; Astle, Maxwell A.; Grey, Clare P.
The structures of ordered defects in thiocyanate analogues of Prussian Blue
Chemical Science, 2020, 11, 4430-4438
1557767 CIFC7 H14 Bi Mn2 N7 O7 S7P 1 21/n 18.3065; 25.8428; 12.2664
90; 90.2358; 90
2633.12Cliffe, Matthew J.; Keyzer, Evan N.; Bond, Andrew D.; Astle, Maxwell A.; Grey, Clare P.
The structures of ordered defects in thiocyanate analogues of Prussian Blue
Chemical Science, 2020, 11, 4430-4438
1557768 CIFC36 H76 Bi6 Co9 N36 O38 S36P -112.0209; 12.1613; 23.8319
94.2; 94.003; 91.452
3464.52Cliffe, Matthew J.; Keyzer, Evan N.; Bond, Andrew D.; Astle, Maxwell A.; Grey, Clare P.
The structures of ordered defects in thiocyanate analogues of Prussian Blue
Chemical Science, 2020, 11, 4430-4438
1557769 CIFC30 H74 Bi5 N33 Ni6 O16 S30P -111.8567; 11.8653; 18.3824
84.0731; 76.714; 85.1942
2498.6Cliffe, Matthew J.; Keyzer, Evan N.; Bond, Andrew D.; Astle, Maxwell A.; Grey, Clare P.
The structures of ordered defects in thiocyanate analogues of Prussian Blue
Chemical Science, 2020, 11, 4430-4438
1557770 CIFC7 H14 Bi Mn2 N7 O7 S7P 1 21/n 18.3698; 26.0037; 12.2466
90; 91.208; 90
2664.83Cliffe, Matthew J.; Keyzer, Evan N.; Bond, Andrew D.; Astle, Maxwell A.; Grey, Clare P.
The structures of ordered defects in thiocyanate analogues of Prussian Blue
Chemical Science, 2020, 11, 4430-4438
1557790 CIFC43 H39 B F4 N2 O2P 1 21/c 114.502; 12.866; 20.32
90; 106.828; 90
3629Zhou, Chengcheng; Jiang, Meijuan; Du, Jian; Bai, Haotian; Shan, Guogang; Kwok, Ryan T. K.; Chau, Joe H. C.; Zhang, Jun; Lam, Jacky W. Y.; Huang, Peng; Tang, Ben Zhong
One stone, three birds: one AIEgen with three colors for fast differentiation of three pathogens
Chemical Science, 2020, 11, 4730-4740
1557811 CIFC35 H33 N O4F 2 d d8.4764; 33.008; 40.934
90; 90; 90
11453Mateos, Javier; Vega-Peñaloza, Alberto; Franceschi, Pietro; Rigodanza, Francesco; Andreetta, Philip; Companyó, Xavier; Pelosi, Giorgio; Bonchio, Marcella; Dell’Amico, Luca
A visible-light Paternò–Büchi dearomatisation process towards the construction of oxeto-indolinic polycycles
Chemical Science, 2020, 11, 6532-6538
1557826 CIFC120 H56 Dy2 N4 Ni OP -114.3857; 14.7255; 19.1301
84.837; 88.064; 61.889
3559.7Velkos, Georgios; Yang, Wei; Yao, Yang-Rong; Sudarkova, Svetlana M.; Liu, XinYe; Büchner, Bernd; Avdoshenko, Stanislav M.; Chen, Ning; Popov, Alexey A.
Shape-adaptive single-molecule magnetism and hysteresis up to 14 K in oxide clusterfullerenes Dy2O@C72 and Dy2O@C74 with fused pentagon pairs and flexible Dy‒(μ2-O)‒Dy angle
Chemical Science, 2020, 11, 4766-4772
1557827 CIFC117 H50 Dy2 N4 Ni O S2P 1 21/c 117.914; 16.589; 25.753
90; 106.775; 90
7327.5Velkos, Georgios; Yang, Wei; Yao, Yang-Rong; Sudarkova, Svetlana M.; Liu, XinYe; Büchner, Bernd; Avdoshenko, Stanislav M.; Chen, Ning; Popov, Alexey A.
Shape-adaptive single-molecule magnetism and hysteresis up to 14 K in oxide clusterfullerenes Dy2O@C72 and Dy2O@C74 with fused pentagon pairs and flexible Dy‒(μ2-O)‒Dy angle
Chemical Science, 2020, 11, 4766-4772
1557828 CIFC82 H88 N14 O12P -110.5727; 12.998; 15.4783
104.398; 102.401; 109.792
1831.32Guo, Chenxing; Wang, Hu; Lynch, Vincent M.; Ji, Xiaofan; Page, Zachariah A.; Sessler, Jonathan L.
Molecular recognition of pyrazine N,N′-dioxide using aryl extended calix[4]pyrroles
Chemical Science, 2020, 11, 5650-5657
1557829 CIFC86 H88 N14 O4P 1 21/n 116.711; 12.6971; 18.2586
90; 99.327; 90
3822.9Guo, Chenxing; Wang, Hu; Lynch, Vincent M.; Ji, Xiaofan; Page, Zachariah A.; Sessler, Jonathan L.
Molecular recognition of pyrazine N,N′-dioxide using aryl extended calix[4]pyrroles
Chemical Science, 2020, 11, 5650-5657
1557830 CIFC78 H92 N14 O6C 1 2/c 112.761; 17.133; 31.684
90; 93.976; 90
6911Guo, Chenxing; Wang, Hu; Lynch, Vincent M.; Ji, Xiaofan; Page, Zachariah A.; Sessler, Jonathan L.
Molecular recognition of pyrazine N,N′-dioxide using aryl extended calix[4]pyrroles
Chemical Science, 2020, 11, 5650-5657
1557831 CIFC4 H4 N2 O2P n m a11.866; 11.883; 6.3933
90; 90; 90
901.5Guo, Chenxing; Wang, Hu; Lynch, Vincent M.; Ji, Xiaofan; Page, Zachariah A.; Sessler, Jonathan L.
Molecular recognition of pyrazine N,N′-dioxide using aryl extended calix[4]pyrroles
Chemical Science, 2020, 11, 5650-5657
1557832 CIFC82 H92 N10 O8R -3 :H43.6284; 43.6284; 10.7942
90; 90; 120
17793.4Guo, Chenxing; Wang, Hu; Lynch, Vincent M.; Ji, Xiaofan; Page, Zachariah A.; Sessler, Jonathan L.
Molecular recognition of pyrazine N,N′-dioxide using aryl extended calix[4]pyrroles
Chemical Science, 2020, 11, 5650-5657
1557833 CIFC53 H52 N6 O7P 1 21/c 110.9587; 59.0761; 22.009
90; 101.952; 90
13939.7Guo, Chenxing; Wang, Hu; Lynch, Vincent M.; Ji, Xiaofan; Page, Zachariah A.; Sessler, Jonathan L.
Molecular recognition of pyrazine N,N′-dioxide using aryl extended calix[4]pyrroles
Chemical Science, 2020, 11, 5650-5657
1557834 CIFC208.5 H180 Fe8 N12P -119.2992; 19.3512; 27.206
105.998; 90.079; 119.907
8348.1Cook, Andrew W.; Bocarsly, Joshua D.; Lewis, Richard A.; Touchton, Alexander J.; Morochnik, Simona; Hayton, Trevor W.
An iron ketimide single-molecule magnet [Fe4(NCPh2)6] with suppressed through-barrier relaxation
Chemical Science, 2020, 11, 4753-4757
1557836 CIFC26 H43 Al I2 N2P 1 21/n 110.145; 17.053; 17.044
90; 102.029; 90
2883.9Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi
Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis
Chemical Science, 2020, 11, 4817-4827
1557837 CIFC58 H100 Al2 N4 O1.79C 1 2/c 136.035; 15.3951; 21.8876
90; 104.19; 90
11771.9Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi
Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis
Chemical Science, 2020, 11, 4817-4827
1557838 CIFC72 H102 Al2 N4P 1 2/c 113.5339; 13.5131; 18.1559
90; 100.481; 90
3265Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi
Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis
Chemical Science, 2020, 11, 4817-4827
1557839 CIFC70 H104 Al2 N6C 1 2/c 121.6994; 15.8898; 20.777
90; 90.177; 90
7163.9Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi
Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis
Chemical Science, 2020, 11, 4817-4827
1557840 CIFC54 H90 Al2 N4P 1 21/c 112.4062; 18.1378; 24.62
90; 101.846; 90
5422Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi
Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis
Chemical Science, 2020, 11, 4817-4827
1557841 CIFC55 H93 Al2 N4C 1 2/c 135.126; 15.4352; 21.8147
90; 109.512; 90
11148.2Weetman, Catherine; Porzelt, Amelie; Bag, Prasenjit; Hanusch, Franziska; Inoue, Shigeyoshi
Dialumenes ‒ aryl vs. silyl stabilisation for small molecule activation and catalysis
Chemical Science, 2020, 11, 4817-4827
1557864 CIFC44 H59 In N2 O SP 1 21/c 118.3672; 14.0583; 17.9736
90; 118.814; 90
4066.4Goonesinghe, Chatura; Roshandel, Hootan; Diaz, Carlos; Jung, Hyuk-Joon; Nyamayaro, Kudzanai; Ezhova, Maria; Mehrkhodavandi, Parisa
Cationic indium catalysts for ring opening polymerization: tuning reactivity with hemilabile ligands
Chemical Science, 2020, 11, 6485-6491
1557865 CIFC44 H59 In N2 O2P 1 21/c 117.5732; 13.8493; 18.4226
90; 117.891; 90
3962.8Goonesinghe, Chatura; Roshandel, Hootan; Diaz, Carlos; Jung, Hyuk-Joon; Nyamayaro, Kudzanai; Ezhova, Maria; Mehrkhodavandi, Parisa
Cationic indium catalysts for ring opening polymerization: tuning reactivity with hemilabile ligands
Chemical Science, 2020, 11, 6485-6491
1557866 CIFC46 H61 In N2 OP 1 21/n 118.402; 13.9008; 18.4542
90; 119.051; 90
4126.7Goonesinghe, Chatura; Roshandel, Hootan; Diaz, Carlos; Jung, Hyuk-Joon; Nyamayaro, Kudzanai; Ezhova, Maria; Mehrkhodavandi, Parisa
Cationic indium catalysts for ring opening polymerization: tuning reactivity with hemilabile ligands
Chemical Science, 2020, 11, 6485-6491
1557867 CIFC45 H60 In N3 OP 1 21/c 118.3804; 13.9887; 18.328
90; 119.839; 90
4087.7Goonesinghe, Chatura; Roshandel, Hootan; Diaz, Carlos; Jung, Hyuk-Joon; Nyamayaro, Kudzanai; Ezhova, Maria; Mehrkhodavandi, Parisa
Cationic indium catalysts for ring opening polymerization: tuning reactivity with hemilabile ligands
Chemical Science, 2020, 11, 6485-6491
1557868 CIFC88 H92 B F24 In N2 O6P -112.616; 13.343; 26.255
80.163; 76.369; 85.869
4229.7Goonesinghe, Chatura; Roshandel, Hootan; Diaz, Carlos; Jung, Hyuk-Joon; Nyamayaro, Kudzanai; Ezhova, Maria; Mehrkhodavandi, Parisa
Cationic indium catalysts for ring opening polymerization: tuning reactivity with hemilabile ligands
Chemical Science, 2020, 11, 6485-6491
1557869 CIFC14 H17 Br O4P b c n21.874; 15.366; 8.915
90; 90; 90
2996.5Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557870 CIFC26 H25 Cl8 N O4 SbP 1 21/n 111.6398; 18.4868; 16.2027
90; 109.07; 90
3295.2Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557871 CIFC26 H25 Cl2 N O4P b c a18.383; 13.3271; 20.1022
90; 90; 90
4924.9Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557872 CIFC32 H33 F6 N O4P -110.089; 11.8293; 13.7884
97.567; 107.754; 95.274
1538.29Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557873 CIFC28 H31 N O6P 1 21/c 110.3036; 18.9257; 13.0352
90; 94.843; 90
2532.8Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557874 CIFC28 H25 F6 N O4P 1 21/n 111.7241; 12.3047; 18.3432
90; 100.077; 90
2605.4Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557875 CIFC30 H33 Cl2 N O4P -111.84; 14.543; 18.231
97.047; 105.059; 102.364
2907.7Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557876 CIFC30 H33 Cl8 N O4 SbP 1 21/n 112.156; 15.548; 19.482
90; 90.77; 90
3681.8Yan, Chenting; Takeshita, Masato; Nakatsuji, Jun-ya; Kurosaki, Akihiro; Sato, Kaoko; Shang, Rong; Nakamoto, Masaaki; Yamamoto, Yohsuke; Adachi, Yohei; Furukawa, Ko; Kishi, Ryohei; Nakano, Masayoshi
Synthesis and properties of hypervalent electron-rich pentacoordinate nitrogen compounds
Chemical Science, 2020, 11, 5082-5088
1557898 CIFC12 H28 B Co F4 N5 O2P b c a13.0883; 14.8329; 19.5325
90; 90; 90
3791.99Das, Sandip; Kulbir,; Ghosh, Somnath; Chandra Sahoo, Subash; Kumar, Pankaj
Nitric oxide monooxygenation (NOM) reaction of cobalt-nitrosyl {Co(NO)}8 to CoII-nitrito {CoII(NO2−)}: base induced hydrogen gas (H2) evolution
Chemical Science, 2020, 11, 5037-5042
1557899 CIFC76 H76 Cl2 F14 N4 Ni2 O2 P2 Sb2P -110.5566; 14.6779; 14.7391
109.074; 108.271; 97.907
1974.9Yang, Jian; Postils, Verònica; Lipschutz, Michael I.; Fasulo, Meg; Raynaud, Christophe; Clot, Eric; Eisenstein, Odile; Tilley, T. Don
Efficient alkene hydrosilation with bis(8-quinolyl)phosphine (NPN) nickel catalysts. The dominant role of silyl-over hydrido-nickel catalytic intermediates
Chemical Science, 2020, 11, 5043-5051
1557900 CIFC30 H26 F3 N3 OP 1 21/n 114.0809; 10.9917; 17.1659
90; 108.846; 90
2514.4Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557901 CIFC42 H34 F9 N OP c c n37.632; 14.8891; 13.0219
90; 90; 90
7296.3Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557902 CIFC34 H42 N2 O2P -113.5226; 14.169; 17.1029
103.45; 107.34; 103.234
2881Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C–H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557903 CIFC43 H35 F9 N2 OP -19.7571; 10.1037; 19.23
86.6; 88.612; 81.412
1870.97Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557904 CIFC31 H42 N2 O4P 1 21/n 112.9747; 12.3749; 17.7595
90; 101.948; 90
2789.71Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557905 CIFC32 H40 N2 O2P 1 21/n 110.4974; 24.3; 11.3737
90; 109.196; 90
2739.97Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557906 CIFC31 H39 N3 O2P -18.974; 11.737; 14.0121
113.955; 97.7538; 91.349
1331.4Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557907 CIFC29 H37 N3 O2P b c a16.4161; 12.4001; 25.3104
90; 90; 90
5152.2Okude, Ryo; Mori, Genki; Yagi, Akiko; Itami, Kenichiro
Programmable synthesis of multiply arylated cubanes through C‒H metalation and arylation
Chemical Science, 2020, 11, 7672-7675
1557908 CIFC38 H32 Cd N6 O6 S3P c c a19.0673; 26.1197; 15.5005
90; 90; 90
7719.7Doheny, Patrick W.; Clegg, Jack K.; Tuna, Floriana; Collison, David; Kepert, Cameron J.; D'Alessandro, Deanna M.
Quantification of the mixed-valence and intervalence charge transfer properties of a cofacial metal‒organic framework via single crystal electronic absorption spectroscopy
Chemical Science, 2020, 11, 5213-5220
1557909 CIFC26 H16 N4 S2P -15.665; 7.55; 22.845
80.52; 86.53; 88.94
962Doheny, Patrick W.; Clegg, Jack K.; Tuna, Floriana; Collison, David; Kepert, Cameron J.; D'Alessandro, Deanna M.
Quantification of the mixed-valence and intervalence charge transfer properties of a cofacial metal‒organic framework via single crystal electronic absorption spectroscopy
Chemical Science, 2020, 11, 5213-5220
1557923 CIFC44 H30P -19.9378; 9.9882; 17.7699
93.791; 94.905; 98.931
1730.4Curbet, Idriss; Colombel-Rouen, Sophie; Manguin, Romane; Clermont, Anthony; Quelhas, Alexandre; Müller, Daniel S.; Roisnel, Thierry; Baslé, Olivier; Trolez, Yann; Mauduit, Marc
Expedient synthesis of conjugated triynes via alkyne metathesis
Chemical Science, 2020, 11, 4934-4938
1557924 CIFC43 H31 Cl3 Si2P 1 21/n 110.4193; 21.2154; 17.2115
90; 99.801; 90
3749.1Curbet, Idriss; Colombel-Rouen, Sophie; Manguin, Romane; Clermont, Anthony; Quelhas, Alexandre; Müller, Daniel S.; Roisnel, Thierry; Baslé, Olivier; Trolez, Yann; Mauduit, Marc
Expedient synthesis of conjugated triynes via alkyne metathesis
Chemical Science, 2020, 11, 4934-4938
1557925 CIFC34 H36 SiP -18.5423; 10.4335; 16.821
76.313; 77.803; 83.761
1421Curbet, Idriss; Colombel-Rouen, Sophie; Manguin, Romane; Clermont, Anthony; Quelhas, Alexandre; Müller, Daniel S.; Roisnel, Thierry; Baslé, Olivier; Trolez, Yann; Mauduit, Marc
Expedient synthesis of conjugated triynes via alkyne metathesis
Chemical Science, 2020, 11, 4934-4938
1557926 CIFC34 H26P -18.5611; 10.3957; 14.5334
94.453; 104.612; 98.456
1229.1Curbet, Idriss; Colombel-Rouen, Sophie; Manguin, Romane; Clermont, Anthony; Quelhas, Alexandre; Müller, Daniel S.; Roisnel, Thierry; Baslé, Olivier; Trolez, Yann; Mauduit, Marc
Expedient synthesis of conjugated triynes via alkyne metathesis
Chemical Science, 2020, 11, 4934-4938
1557927 CIFC14 H14P -17.5855; 8.3989; 17.377
90.902; 91.564; 91.339
1106.2Curbet, Idriss; Colombel-Rouen, Sophie; Manguin, Romane; Clermont, Anthony; Quelhas, Alexandre; Müller, Daniel S.; Roisnel, Thierry; Baslé, Olivier; Trolez, Yann; Mauduit, Marc
Expedient synthesis of conjugated triynes via alkyne metathesis
Chemical Science, 2020, 11, 4934-4938
1557928 CIFC24 H18P 21 21 219.3055; 10.3538; 18.151
90; 90; 90
1748.8Curbet, Idriss; Colombel-Rouen, Sophie; Manguin, Romane; Clermont, Anthony; Quelhas, Alexandre; Müller, Daniel S.; Roisnel, Thierry; Baslé, Olivier; Trolez, Yann; Mauduit, Marc
Expedient synthesis of conjugated triynes via alkyne metathesis
Chemical Science, 2020, 11, 4934-4938
1557943 CIFC24 H14 F24 O10 ThC 1 2/c 112.8993; 15.9751; 17.3394
90; 97.371; 90
3543.6Moreau, Liane M.; Herve, Alexandre; Straub, Mark D.; Russo, Dominic R.; Abergel, Rebecca J.; Alayoglu, Selim; Arnold, John; Braun, Augustin; Deblonde, Gauthier J. P.; Liu, Yangdongling; Lohrey, Trevor D.; Olive, Daniel T.; Qiao, Yusen; Rees, Julian A.; Shuh, David K.; Teat, Simon J.; Booth, Corwin H.; Minasian, Stefan G.
Structural properties of ultra-small thorium and uranium dioxide nanoparticles embedded in a covalent organic framework
Chemical Science, 2020, 11, 4648-4668
1557944 CIFC20 H4 F24 O8 UI 41/a :217.4457; 17.4457; 29.8629
90; 90; 90
9088.8Moreau, Liane M.; Herve, Alexandre; Straub, Mark D.; Russo, Dominic R.; Abergel, Rebecca J.; Alayoglu, Selim; Arnold, John; Braun, Augustin; Deblonde, Gauthier J. P.; Liu, Yangdongling; Lohrey, Trevor D.; Olive, Daniel T.; Qiao, Yusen; Rees, Julian A.; Shuh, David K.; Teat, Simon J.; Booth, Corwin H.; Minasian, Stefan G.
Structural properties of ultra-small thorium and uranium dioxide nanoparticles embedded in a covalent organic framework
Chemical Science, 2020, 11, 4648-4668
1557955 CIFC87 H77.33 F6 N12 O23.67 Ru3R -3 :H23.4927; 23.4927; 32.5166
90; 90; 120
15541.8Meza-Chincha, Ana-Lucia; Lindner, Joachim O.; Schindler, Dorothee; Schmidt, David; Krause, Ana-Maria; Röhr, Merle I. S.; Mitrić, Roland; Würthner, Frank
Impact of substituents on molecular properties and catalytic activities of trinuclear Ru macrocycles in water oxidation
Chemical Science, 2020, 11, 7654-7664
1557956 CIFC84 H48 F6 N12 O12 Ru3P -115.9552; 18.9386; 21.0317
65.145; 87.292; 76.631
5601.2Meza-Chincha, Ana-Lucia; Lindner, Joachim O.; Schindler, Dorothee; Schmidt, David; Krause, Ana-Maria; Röhr, Merle I. S.; Mitrić, Roland; Würthner, Frank
Impact of substituents on molecular properties and catalytic activities of trinuclear Ru macrocycles in water oxidation
Chemical Science, 2020, 11, 7654-7664
1557967 CIFC32 H52 Li2 N2 O4P 1 21/c 19.0773; 20.9604; 9.2929
90; 112.088; 90
1638.34Fairley, Michael; Bole, Leonie J.; Mulks, Florian F.; Main, Laura; Kennedy, Alan R.; O'Hara, Charles T; García-Alvarez, Joaquín; Hevia, Eva
Ultrafast amidation of esters using lithium amides under aerobic ambient temperature conditions in sustainable solvents.
Chemical science, 2020, 11, 6500-6509
1557968 CIFC30 H36 Li2 N6 O2P 1 21/n 19.7406; 10.9189; 14.1465
90; 107.012; 90
1438.74Fairley, Michael; Bole, Leonie J.; Mulks, Florian F.; Main, Laura; Kennedy, Alan R.; O'Hara, Charles T; García-Alvarez, Joaquín; Hevia, Eva
Ultrafast amidation of esters using lithium amides under aerobic ambient temperature conditions in sustainable solvents.
Chemical science, 2020, 11, 6500-6509
1557969 CIFC44 H60 Li2 N2 O4P 1 21 110.2268; 19.0435; 10.7658
90; 102.453; 90
2047.36Fairley, Michael; Bole, Leonie J.; Mulks, Florian F.; Main, Laura; Kennedy, Alan R.; O'Hara, Charles T; García-Alvarez, Joaquín; Hevia, Eva
Ultrafast amidation of esters using lithium amides under aerobic ambient temperature conditions in sustainable solvents.
Chemical science, 2020, 11, 6500-6509
1557970 CIFC42 H42 Li2 N4 O2P -19.5878; 9.9347; 9.9435
105.659; 94.885; 95.34
902Fairley, Michael; Bole, Leonie J.; Mulks, Florian F.; Main, Laura; Kennedy, Alan R.; O'Hara, Charles T; García-Alvarez, Joaquín; Hevia, Eva
Ultrafast amidation of esters using lithium amides under aerobic ambient temperature conditions in sustainable solvents.
Chemical science, 2020, 11, 6500-6509
1557971 CIFC17 H17 F6 N2 PP 1 21/n 16.8004; 11.9948; 21.5
90; 95.373; 90
1746Zhang, Ruoyao; Niu, Guangle; Lu, Qing; Huang, Xiaolin; Chau, Joe H. C.; Kwok, Ryan T. K.; Yu, Xiaoqiang; Li, Min-Hui; Lam, Jacky W. Y.; Tang, Ben Zhong
Cancer cell discrimination and dynamic viability monitoring through wash-free bioimaging using AIEgens
Chemical Science, 2020, 11, 7676-7684
1557972 CIFC26 H19 N O SP 1 21 19.8666; 9.9949; 11.3565
90; 114.722; 90
1017.3Singh, Bara; Bankar, Siddheshwar K.; Kumar, Ketan; Ramasastry, S. S. V.
Palladium-catalysed 5-endo-trig allylic (hetero)arylation
Chemical Science, 2020, 11, 4948-4953
1557973 CIFC18 H20 SP 1 21/c 110.0379; 9.5393; 16.2242
90; 104.646; 90
1503.1Singh, Bara; Bankar, Siddheshwar K.; Kumar, Ketan; Ramasastry, S. S. V.
Palladium-catalysed 5-endo-trig allylic (hetero)arylation
Chemical Science, 2020, 11, 4948-4953
1557987 CIFC33 H48 I N4 O P PtP c c n24.4749; 22.6183; 12.7406
90; 90; 90
7052.9Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557988 CIFC26 H39 Cl2 Cu2 N4 O P PtP 1 21/c 112.7739; 8.98822; 27.115
90; 100.703; 90
3059.04Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557989 CIFC50 H70 N8 O2 P2 Pt2I 41/a :220.4659; 20.4659; 27.7779
90; 90; 90
11634.9Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557990 CIFC42 H59 B Cu F4 N4 O4 P PtP -111.34455; 12.7555; 15.58801
97.0654; 96.2303; 94.2103
2216.7Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557991 CIFC30 H47 B Cu F4 N4 O2 P PtP 1 21/c 19.1729; 30.0139; 12.3335
90; 90.445; 90
3395.5Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557992 CIFC28.33 H43.67 Cu N4 O1.33 P PtP 1 21/c 19.1454; 34.4731; 28.8368
90; 90.3193; 90
9091.2Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557993 CIFC58 H51 B Cu F24 N4 O P PtP 1 21/c 114.66021; 16.24537; 26.9484
90; 103.68; 90
6235.97Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557994 CIFC65 H51 B Cu F30 N4 O P PtP 1 21/c 120.7797; 19.37993; 17.2379
90; 105.44; 90
6691.33Deolka, Shubham; Rivada-Wheelaghan, Orestes; Aristizábal, Sandra L.; Fayzullin, Robert R.; Pal, Shrinwantu; Nozaki, Kyoko; Khaskin, Eugene; Khusnutdinova, Julia R.
Metal‒metal cooperative bond activation by heterobimetallic alkyl, aryl, and acetylide PtII/CuI complexes
Chemical Science, 2020, 11, 5494-5502
1557997 CIFC21 H18P 1 21/c 17.2298; 10.3241; 19.9155
90; 91.2503; 90
1486.16Wang, Bin; Ong, Derek Yiren; Li, Yihang; Pang, Jia Hao; Watanabe, Kohei; Takita, Ryo; Chiba, Shunsuke
Stereo-controlled anti-hydromagnesiation of aryl alkynes by magnesium hydrides
Chemical Science, 2020, 11, 5267-5272
1557998 CIFC24 H25 N OP 1 21/n 111.9769; 5.9444; 26.845
90; 92.8945; 90
1908.8Wang, Bin; Ong, Derek Yiren; Li, Yihang; Pang, Jia Hao; Watanabe, Kohei; Takita, Ryo; Chiba, Shunsuke
Stereo-controlled anti-hydromagnesiation of aryl alkynes by magnesium hydrides
Chemical Science, 2020, 11, 5267-5272
1557999 CIFC31 H37 Br N O2 SiP 1 21/c 119.002; 8.3505; 18.6504
90; 106.546; 90
2836.83Eichenberger, Sarah; Hönig, Moritz; Richter, Matthieu J. R.; Gershoni-Poranne, Renana; Carreira, Erick M.
Ring-fused cyclobutanes via cycloisomerization of alkylidenecyclopropane acylsilanes
Chemical Science, 2020, 11, 5294-5298
1558010 CIFC31 H20P 1 21/c 113.3029; 9.8247; 16.8935
90; 110.005; 90
2074.7Wang, Qiang; Lucas, Fabien; Quinton, Cassandre; Qu, Yang-Kun; Rault-Berthelot, Joëlle; Jeannin, Olivier; Yang, Sheng-Yi; Kong, Fan-Cheng; Kumar, Sarvendra; Liao, Liang-Sheng; Poriel, Cyril; Jiang, Zuo-Quan
Evolution of pure hydrocarbon hosts: simpler structure, higher performance and universal application in RGB phosphorescent organic light-emitting diodes
Chemical Science, 2020, 11, 4887-4894
1558011 CIFC37 H24P 1 21/a 116.6398; 9.562; 16.8786
90; 106.273; 90
2578Wang, Qiang; Lucas, Fabien; Quinton, Cassandre; Qu, Yang-Kun; Rault-Berthelot, Joëlle; Jeannin, Olivier; Yang, Sheng-Yi; Kong, Fan-Cheng; Kumar, Sarvendra; Liao, Liang-Sheng; Poriel, Cyril; Jiang, Zuo-Quan
Evolution of pure hydrocarbon hosts: simpler structure, higher performance and universal application in RGB phosphorescent organic light-emitting diodes
Chemical Science, 2020, 11, 4887-4894
1558012 CIFC43 H28P 1 21/c 111.2023; 18.671; 14.855
90; 108.22; 90
2951.3Wang, Qiang; Lucas, Fabien; Quinton, Cassandre; Qu, Yang-Kun; Rault-Berthelot, Joëlle; Jeannin, Olivier; Yang, Sheng-Yi; Kong, Fan-Cheng; Kumar, Sarvendra; Liao, Liang-Sheng; Poriel, Cyril; Jiang, Zuo-Quan
Evolution of pure hydrocarbon hosts: simpler structure, higher performance and universal application in RGB phosphorescent organic light-emitting diodes
Chemical Science, 2020, 11, 4887-4894
1558013 CIFBe4 H51 I2 N19P 39.7756; 9.7756; 8.7186
90; 90; 120
721.55Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558014 CIFBe4 H42 N22C 1 2/c 113.4543; 10.5289; 16.9967
90; 111.134; 90
2245.79Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558015 CIFBe4 Br2 H36 N14P 314.2177; 14.2177; 8.56
90; 90; 120
1498.5Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558016 CIFBe4 Cl2 H36 N14P 313.9342; 13.9342; 8.3727
90; 90; 120
1407.86Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558017 CIFBe4 H42 I2 N16C 1 2/c 114.0852; 10.1719; 18.4646
90; 112.217; 90
2449.08Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558018 CIFC2 H33 Be4 N15 S2P 1 21/c 19.9563; 8.5843; 24.7099
90; 97.454; 90
2094.06Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558019 CIFC8 H16 Be N6P 42 21 29.9478; 9.9478; 5.4077
90; 90; 90
535.14Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558020 CIFC2 H36 Be4 N16P 314.1334; 14.1334; 8.5563
90; 90; 120
1480.16Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558021 CIFC20 H44 Be8 I2 N16 OC c c m20.1994; 21.2118; 23.3361
90; 90; 90
9998.72Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558023 CIFC5 H8 O5P 1 21/c 19.8512; 5.7699; 11.7734
90; 102.85; 90
652.45Vil', Vera A.; Barsegyan, Yana A.; Kuhn, Leah; Ekimova, Maria V.; Semenov, Egor A.; Korlyukov, Alexander A.; Terent'ev, Alexander O.; Alabugin, Igor V.
Synthesis of unstrained Criegee intermediates: inverse α-effect and other protective stereoelectronic forces can stop Baeyer‒Villiger rearrangement of γ-hydroperoxy-γ-peroxylactones
Chemical Science, 2020, 11, 5313-5322
1558028 CIFC168 H114 N12 O64 Zr12I m -3 m38.649; 38.649; 38.649
90; 90; 90
57732Zee, David Z.; Harris, T. David
Enhancing catalytic alkane hydroxylation by tuning the outer coordination sphere in a heme-containing metal-organic framework.
Chemical science, 2020, 11, 5447-5452
1558029 CIFC168 H108 Cl3 Fe3 N12 O64 Zr12I m -3 m38.4891; 38.4891; 38.4891
90; 90; 90
57018Zee, David Z.; Harris, T. David
Enhancing catalytic alkane hydroxylation by tuning the outer coordination sphere in a heme-containing metal-organic framework.
Chemical science, 2020, 11, 5447-5452
1558030 CIFC144 H90 N12 O52 Zr12I m -3 m38.8372; 38.8372; 38.8372
90; 90; 90
58579Zee, David Z.; Harris, T. David
Enhancing catalytic alkane hydroxylation by tuning the outer coordination sphere in a heme-containing metal-organic framework.
Chemical science, 2020, 11, 5447-5452
1558031 CIFC13 H14 N4 OP 41 21 27.749; 7.749; 22.032
90; 90; 90
1322.96Heywood, Victoria L.; Alford, Thomas P. J.; Roeleveld, Julius J.; Lekanne Deprez, Siebe J.; Verhoofstad, Abraham; van der Vlugt, Jarl Ivar; Domingos, Sérgio R.; Schnell, Melanie; Davis, Anthony P.; Mooibroek, Tiddo J.
Observations of tetrel bonding between sp3-carbon and THF
Chemical Science, 2020, 11, 5289-5293
1558032 CIFC152 H112 Fe4 N16 O18P 1 21/c 115.7335; 15.6057; 26.314
90; 100.54; 90
6351.9Amanullah, Sk; Dey, Abhishek
The role of porphyrin peripheral substituents in determining the reactivities of ferrous nitrosyl species.
Chemical science, 2020, 11, 5909-5921
1558033 CIFC90 H74 Cl6 N8 O16 Zn2P -111.301; 13.669; 14.795
92.292; 90.441; 109.916
2146.5Amanullah, Sk; Dey, Abhishek
The role of porphyrin peripheral substituents in determining the reactivities of ferrous nitrosyl species.
Chemical science, 2020, 11, 5909-5921
1558034 CIFC45 H38 N5 O5 ZnP n m a13.344; 21.257; 14.059
90; 90; 90
3987.9Amanullah, Sk; Dey, Abhishek
The role of porphyrin peripheral substituents in determining the reactivities of ferrous nitrosyl species.
Chemical science, 2020, 11, 5909-5921
1558046 CIFC66 H118 N4 Si10P -113.4808; 14.1304; 20.7309
81.16; 85.017; 77.197
3799.4Keuter, Jan; Schwermann, Christian; Hepp, Alexander; Bergander, Klaus; Droste, Jörn; Hansen, Michael Ryan; Doltsinis, Nikos L.; Mück-Lichtenfeld, Christian; Lips, Felicitas
A highly unsaturated six-vertex amido-substituted silicon cluster.
Chemical science, 2020, 11, 5895-5901
1558047 CIFC40 H35 B F4P 1 21/c 111.9911; 34.2594; 15.9758
90; 107.614; 90
6255.29Fu, Xiangyu; Han, Han; Zhang, Di; Yu, Han; He, Qilin; Zhao, Dahui
A polycyclic aromatic hydrocarbon diradical with pH-responsive magnetic properties.
Chemical science, 2020, 11, 5565-5571
1558050 CIFC15 H12 N4P 1 21/c 118.3346; 15.7546; 18.3241
90; 90.531; 90
5292.8Horiuchi, Sachio; Ishibashi, Shoji; Haruki, Rie; Kumai, Reiji; Inada, Satoshi; Aoyagi, Shigenobu
Metaelectric multiphase transitions in a highly polarizable molecular crystal.
Chemical science, 2020, 11, 6183-6192
1558051 CIFC15 H12 N4P 4318.3126; 18.3126; 15.7252
90; 90; 90
5273.5Horiuchi, Sachio; Ishibashi, Shoji; Haruki, Rie; Kumai, Reiji; Inada, Satoshi; Aoyagi, Shigenobu
Metaelectric multiphase transitions in a highly polarizable molecular crystal.
Chemical science, 2020, 11, 6183-6192
1558052 CIFC15 H12 N4P 4118.2293; 18.2293; 15.6088
90; 90; 90
5186.9Horiuchi, Sachio; Ishibashi, Shoji; Haruki, Rie; Kumai, Reiji; Inada, Satoshi; Aoyagi, Shigenobu
Metaelectric multiphase transitions in a highly polarizable molecular crystal.
Chemical science, 2020, 11, 6183-6192
1558053 CIFC31 H28 N8 OC 1 2/c 122.088; 5.586; 24.017
90; 115.257; 90
2680Horiuchi, Sachio; Ishibashi, Shoji; Haruki, Rie; Kumai, Reiji; Inada, Satoshi; Aoyagi, Shigenobu
Metaelectric multiphase transitions in a highly polarizable molecular crystal.
Chemical science, 2020, 11, 6183-6192
1558054 CIFC15 H12 N4P 1 21/c 118.3296; 15.7595; 18.3254
90; 90.612; 90
5293.3Horiuchi, Sachio; Ishibashi, Shoji; Haruki, Rie; Kumai, Reiji; Inada, Satoshi; Aoyagi, Shigenobu
Metaelectric multiphase transitions in a highly polarizable molecular crystal.
Chemical science, 2020, 11, 6183-6192
1558058 CIFC38 H60 Al N3P 1 21/n 110.236; 32.92; 10.7797
90; 105.178; 90
3505.7Drescher, Regina; Lin, Shujuan; Hofmann, Alexander; Lenczyk, Carsten; Kachel, Stephanie; Krummenacher, Ivo; Lin, Zhenyang; Braunschweig, Holger
Ring expansion of alumoles with organic azides: selective formation of six-membered aluminum-nitrogen heterocycles.
Chemical science, 2020, 11, 5559-5564
1558059 CIFC32 H58 Al2P 1 21/n 18.755; 15.965; 11.067
90; 96.64; 90
1536.5Drescher, Regina; Lin, Shujuan; Hofmann, Alexander; Lenczyk, Carsten; Kachel, Stephanie; Krummenacher, Ivo; Lin, Zhenyang; Braunschweig, Holger
Ring expansion of alumoles with organic azides: selective formation of six-membered aluminum-nitrogen heterocycles.
Chemical science, 2020, 11, 5559-5564
1558060 CIFC36 H59 Al N2P 1 21/n 112.957; 16.692; 15.618
90; 96.13; 90
3359Drescher, Regina; Lin, Shujuan; Hofmann, Alexander; Lenczyk, Carsten; Kachel, Stephanie; Krummenacher, Ivo; Lin, Zhenyang; Braunschweig, Holger
Ring expansion of alumoles with organic azides: selective formation of six-membered aluminum-nitrogen heterocycles.
Chemical science, 2020, 11, 5559-5564
1558061 CIFC29 H49 AlP 1 21/n 19.335; 16.672; 17.185
90; 93.88; 90
2668Drescher, Regina; Lin, Shujuan; Hofmann, Alexander; Lenczyk, Carsten; Kachel, Stephanie; Krummenacher, Ivo; Lin, Zhenyang; Braunschweig, Holger
Ring expansion of alumoles with organic azides: selective formation of six-membered aluminum-nitrogen heterocycles.
Chemical science, 2020, 11, 5559-5564
1558062 CIFC32 H58 Al N SiP -19.601; 12.75; 13.314
97.397; 93.793; 94.404
1606.7Drescher, Regina; Lin, Shujuan; Hofmann, Alexander; Lenczyk, Carsten; Kachel, Stephanie; Krummenacher, Ivo; Lin, Zhenyang; Braunschweig, Holger
Ring expansion of alumoles with organic azides: selective formation of six-membered aluminum-nitrogen heterocycles.
Chemical science, 2020, 11, 5559-5564
1558063 CIFC47 H62 Al N3P 1 21/c 119.5714; 14.2192; 14.836
90; 96.397; 90
4103Drescher, Regina; Lin, Shujuan; Hofmann, Alexander; Lenczyk, Carsten; Kachel, Stephanie; Krummenacher, Ivo; Lin, Zhenyang; Braunschweig, Holger
Ring expansion of alumoles with organic azides: selective formation of six-membered aluminum-nitrogen heterocycles.
Chemical science, 2020, 11, 5559-5564
1558064 CIFC22 H28 I2 Ir N3 O2P 1 21/n 19.29339; 13.27724; 20.1881
90; 91.3644; 90
2490.31Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558065 CIFC26 H25.5 F3 I Ir N3 O P0.5P 1 2/c 123.165; 7.44609; 15.706
90; 107.268; 90
2587.01Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558066 CIFC22 H27 Br F6 I Ir N3 O2 PP 1 21/n 19.61097; 20.10144; 14.45419
90; 103.426; 90
2716.15Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558067 CIFC23 H27 F9 I Ir N3 O2 PP 1 21/n 19.8587; 20.2807; 15.0835
90; 105.245; 90
2909.69Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558068 CIFC26 H26 I2 Ir N3P 1 21/c 19.1942; 8.2158; 33.7933
90; 95.783; 90
2539.68Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558069 CIFC21 H24 I2 Ir N3C 1 2/c 131.7681; 8.7023; 16.6407
90; 94.935; 90
4583.36Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558070 CIFC22 H27.5 Cl1.5 Ir N3 O2P 1 21/n 18.93939; 18.6768; 13.452
90; 94.066; 90
2240.28Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558071 CIFC26 H26 Cl F6 Ir N3 O PP -18.71914; 9.9018; 15.7288
89.3248; 78.0376; 88.7062
1328.09Zhang, Wen-Ying; Banerjee, Samya; Hughes, George M.; Bridgewater, Hannah E.; Song, Ji-Inn; Breeze, Ben G.; Clarkson, Guy J.; Coverdale, James P. C.; Sanchez-Cano, Carlos; Ponte, Fortuna; Sicilia, Emilia; Sadler, Peter J.
Ligand-centred redox activation of inert organoiridium anticancer catalysts
Chemical Science, 2020, 11, 5466-5480
1558075 CIFC21 H21 Fe N O3P 21 21 217.9439; 8.6162; 25.8718
90; 90; 90
1770.83Larin, Egor M.; Loup, Joachim; Polishchuk, Iuliia; Ross, Rachel J.; Whyte, Andrew; Lautens, Mark
Enantio- and diastereoselective conjugate borylation/Mannich cyclization
Chemical Science, 2020, 11, 5716-5723
1558076 CIFC34 H72 B4 Dy2 O2P -110.0067; 14.2962; 16.3689
99.987; 105.704; 107.788
2061He, Mian; Guo, Fu-Sheng; Tang, Jinkui; Mansikkamäki, Akseli; Layfield, Richard A.
Fulvalene as a platform for the synthesis of a dimetallic dysprosocenium single-molecule magnet.
Chemical science, 2020, 11, 5745-5752
1558077 CIFC46 H78 B2 Dy2P 1 21/n 113.3199; 18.1439; 19.6411
90; 107.366; 90
4530.39He, Mian; Guo, Fu-Sheng; Tang, Jinkui; Mansikkamäki, Akseli; Layfield, Richard A.
Fulvalene as a platform for the synthesis of a dimetallic dysprosocenium single-molecule magnet.
Chemical science, 2020, 11, 5745-5752
1558078 CIFC70 H74 B2 Dy2 F20P 1 21/n 118.1029; 20.9327; 19.4229
90; 111.812; 90
6833.2He, Mian; Guo, Fu-Sheng; Tang, Jinkui; Mansikkamäki, Akseli; Layfield, Richard A.
Fulvalene as a platform for the synthesis of a dimetallic dysprosocenium single-molecule magnet.
Chemical science, 2020, 11, 5745-5752
1558079 CIFC56 H128 Ce K N16 P4P -113.16; 13.956; 23.75
74.835; 81.559; 65.275
3820.6Rice, Natalie T.; Popov, Ivan A.; Russo, Dominic R.; Gompa, Thaige P.; Ramanathan, Arun; Bacsa, John; Batista, Enrique R.; Yang, Ping; La Pierre, Henry S.
Comparison of tetravalent cerium and terbium ions in a conserved, homoleptic imidophosphorane ligand field.
Chemical science, 2020, 11, 6149-6159
1558080 CIFC56 H128 Ce N16 P4I -413.3726; 13.3726; 21.0511
90; 90; 90
3764.5Rice, Natalie T.; Popov, Ivan A.; Russo, Dominic R.; Gompa, Thaige P.; Ramanathan, Arun; Bacsa, John; Batista, Enrique R.; Yang, Ping; La Pierre, Henry S.
Comparison of tetravalent cerium and terbium ions in a conserved, homoleptic imidophosphorane ligand field.
Chemical science, 2020, 11, 6149-6159
1558082 CIFC38 H50 Co N P2 SP 1 21/n 114.5788; 14.6329; 16.7346
90; 96.683; 90
3545.7Foley, Bryan J.; Palit, Chandra Mouli; Bhuvanesh, Nattamai; Zhou, Jia; Ozerov, Oleg V.
Concerted aryl-sulfur reductive elimination from PNP pincer-supported Co(iii) and subsequent Co(i)/Co(iii) comproportionation.
Chemical science, 2020, 11, 6075-6084
1558083 CIFC33 H47 Co N P2P 1 21/c 115.273; 10.83; 18.993
90; 98.062; 90
3110.5Foley, Bryan J.; Palit, Chandra Mouli; Bhuvanesh, Nattamai; Zhou, Jia; Ozerov, Oleg V.
Concerted aryl-sulfur reductive elimination from PNP pincer-supported Co(iii) and subsequent Co(i)/Co(iii) comproportionation.
Chemical science, 2020, 11, 6075-6084
1558084 CIFC34 H48 Co N O2 P2C 1 2/c 133.34; 13.858; 14.143
90; 99.023; 90
6454Foley, Bryan J.; Palit, Chandra Mouli; Bhuvanesh, Nattamai; Zhou, Jia; Ozerov, Oleg V.
Concerted aryl-sulfur reductive elimination from PNP pincer-supported Co(iii) and subsequent Co(i)/Co(iii) comproportionation.
Chemical science, 2020, 11, 6075-6084
1558085 CIFC45 H48 Cl2 Co2 N4 O12C 1 2/c 118.88; 7.915; 30.41
90; 98.22; 90
4498Chen, Xin-Ran; Zhang, Shuo-Qing; Meyer, Tjark H.; Yang, Chun-Hui; Zhang, Qin-Hao; Liu, Ji-Ren; Xu, Hua-Jian; Cao, Fa-He; Ackermann, Lutz; Hong, Xin
Carboxylate breaks the arene C‒H bond via a hydrogen-atom-transfer mechanism in electrochemical cobalt catalysis
Chemical Science, 2020, 11, 5790-5796
1558092 CIFC33 H28 F6 N2 S2P 1 21 110.6734; 13.492; 10.8926
90; 106.158; 90
1506.63Yu, Zhang-Long; Cheng, Yong-Feng; Jiang, Na-Chuan; Wang, Jian; Fan, Li-Wen; Yuan, Yue; Li, Zhong-Liang; Gu, Qiang-Shuai; Liu, Xin-Yuan
Desymmetrization of unactivated bis-alkenes via chiral Brønsted acid-catalysed hydroamination
Chemical Science, 2020, 11, 5987-5993
1558093 CIFC45 H44 N2 O4P 1 21/c 127.3782; 16.4038; 8.0743
90; 96.106; 90
3605.6Samanta, Samaresh; Ray, Subir Kumar; Deolka, Shubham; Saha, Sudipta; K R, Pradeep; Bhowal, Rohit; Ghosh, Nirmalya; Chaudhuri, Debangshu
Safeguarding long-lived excitons from excimer traps in H-aggregated dye-assemblies.
Chemical science, 2020, 11, 5710-5715
1558097 CIFC45 H31 N5 SP -17.8139; 9.9797; 21.6351
87.227; 84.36; 86.871
1674.87Luo, Qing; Li, Lin; Ma, Huili; Lv, Chunyan; Jiang, Xueyan; Gu, Xinggui; An, Zhongfu; Zou, Bo; Zhang, Cheng; Zhang, Yujian
Deep-red fluorescence from isolated dimers: a highly bright excimer and imaging in vivo
Chemical Science, 2020, 11, 6020-6025
1558098 CIFC76 H144 Co2 K2 N4 O15 P8P -113.7131; 15.2042; 25.3794
74.859; 78.818; 65.926
4640.57Piesch, Martin; Seidl, Michael; Scheer, Manfred
Transformations of the cyclo-P4 ligand in [Cp′′′Co(η4-P4)]
Chemical Science, 2020, 11, 6745-6751
1558099 CIFC43 H82 Co Li N2 O7 P4P b c a17.8715; 22.5218; 24.946
90; 90; 90
10040.7Piesch, Martin; Seidl, Michael; Scheer, Manfred
Transformations of the cyclo-P4 ligand in [Cp′′′Co(η4-P4)]
Chemical Science, 2020, 11, 6745-6751
1558100 CIFC53.5 H99 Co2 Li O3.25 P8P 1 21/c 131.947; 15.571; 12.6636
90; 91.67; 90
6296.8Piesch, Martin; Seidl, Michael; Scheer, Manfred
Transformations of the cyclo-P4 ligand in [Cp′′′Co(η4-P4)]
Chemical Science, 2020, 11, 6745-6751
1558101 CIFC25 H50 Co Na O5 P4P -18.8103; 10.6602; 17.7138
78.926; 89.741; 85.158
1626.75Piesch, Martin; Seidl, Michael; Scheer, Manfred
Transformations of the cyclo-P4 ligand in [Cp′′′Co(η4-P4)]
Chemical Science, 2020, 11, 6745-6751
1558102 CIFC80 H156 Co2 Li2 O17.5 P8 Si2P -114.474; 18.2968; 19.7326
87.037; 77.66; 86.306
5090.5Piesch, Martin; Seidl, Michael; Scheer, Manfred
Transformations of the cyclo-P4 ligand in [Cp′′′Co(η4-P4)]
Chemical Science, 2020, 11, 6745-6751
1558103 CIFC53 H106 Co2 Li O6 P8 SiP -114.2675; 15.0423; 18.2337
102.047; 94.044; 114.602
3424.69Piesch, Martin; Seidl, Michael; Scheer, Manfred
Transformations of the cyclo-P4 ligand in [Cp′′′Co(η4-P4)]
Chemical Science, 2020, 11, 6745-6751
1558104 CIFC29 H38 O5P 21 21 2110.047; 11.0487; 24.242
90; 90; 90
2691Li, Xin; He, Songtao; Song, Qiuling
Enantio- and diastereoselective diarylmethylation of 1,3-dicarbonyl compounds
Chemical Science, 2020, 11, 5969-5973
1558105 CIFC33 H37 N O7P 21 21 2110.4833; 14.435; 21.245
90; 90; 90
3214.9Li, Xin; He, Songtao; Song, Qiuling
Enantio- and diastereoselective diarylmethylation of 1,3-dicarbonyl compounds
Chemical Science, 2020, 11, 5969-5973
1558106 CIFC31 H39 O4 SC 1 2 123.808; 10.36; 11.8065
90; 95.046; 90
2900.8Li, Xin; He, Songtao; Song, Qiuling
Enantio- and diastereoselective diarylmethylation of 1,3-dicarbonyl compounds
Chemical Science, 2020, 11, 5969-5973
1558113 CIFC6 H20.8 Gd2 N2 O19.4 P6P -19.756; 10.186; 12.84
98.371; 106.552; 90.234
1208.7Mendes, Ricardo F.; Barbosa, Paula; Domingues, Eddy M.; Silva, Patrícia; Figueiredo, Filipe; Almeida Paz, Filipe A.
Enhanced proton conductivity in a layered coordination polymer.
Chemical science, 2020, 11, 6305-6311
1558114 CIFC35 H59 N2 P Si2 UC 1 c 120.0922; 11.4805; 18.359
90; 120.155; 90
3661.7Ward, Robert J.; Rungthanaphatsophon, Pokpong; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R.
Divergent uranium- versus phosphorus-based reduction of Me3SiN3 with steric modification of phosphido ligands
Chemical Science, 2020, 11, 5830-5835
1558115 CIFC35 H58 N2 P Si2 UP -19.8231; 11.2078; 19.039
82.061; 76.9; 65.055
1849Ward, Robert J.; Rungthanaphatsophon, Pokpong; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R.
Divergent uranium- versus phosphorus-based reduction of Me3SiN3 with steric modification of phosphido ligands
Chemical Science, 2020, 11, 5830-5835
1558116 CIFC33 H56 N P Si2 UP -110.6409; 16.5027; 20.4856
85.363; 89.696; 85.317
3573.6Ward, Robert J.; Rungthanaphatsophon, Pokpong; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R.
Divergent uranium- versus phosphorus-based reduction of Me3SiN3 with steric modification of phosphido ligands
Chemical Science, 2020, 11, 5830-5835
1558117 CIFC73 H70 Cl2 Fe2 N8 O12 S12P -111.3618; 12.1577; 18.2103
98.637; 99.864; 113.651
2202.3Qiu, Ya-Ru; Cui, Long; Cai, Pei-Yu; Yu, Fei; Kurmoo, Mohamedally; Leong, Chanel F.; D'Alessandro, Deanna M; Zuo, Jing-Lin
Enhanced dielectricity coupled to spin-crossover in a one-dimensional polymer iron(ii) incorporating tetrathiafulvalene.
Chemical science, 2020, 11, 6229-6235
1558118 CIFC36 H34 Fe N4 O6 S6P -111.36; 12.085; 16.842
91.22; 109.72; 111.47
1998Qiu, Ya-Ru; Cui, Long; Cai, Pei-Yu; Yu, Fei; Kurmoo, Mohamedally; Leong, Chanel F.; D'Alessandro, Deanna M; Zuo, Jing-Lin
Enhanced dielectricity coupled to spin-crossover in a one-dimensional polymer iron(ii) incorporating tetrathiafulvalene.
Chemical science, 2020, 11, 6229-6235
1558119 CIFC28 H31 N3 O6 S6P 1 21/c 14.795; 25.807; 26.902
90; 91.827; 90
3327.3Qiu, Ya-Ru; Cui, Long; Cai, Pei-Yu; Yu, Fei; Kurmoo, Mohamedally; Leong, Chanel F.; D'Alessandro, Deanna M; Zuo, Jing-Lin
Enhanced dielectricity coupled to spin-crossover in a one-dimensional polymer iron(ii) incorporating tetrathiafulvalene.
Chemical science, 2020, 11, 6229-6235
1558120 CIFC25 H31 B F2 N2 OP -17.9871; 15.6608; 19.341
74.494; 87.66; 76.49
2266.1Clark, Ryan; Nawawi, Mohd A.; Dobre, Ana; Pugh, David; Liu, Qingshan; Ivanov, Aleksandar P.; White, Andrew J. P.; Edel, Joshua B.; Kuimova, Marina K.; McIntosh, Alastair J. S.; Welton, Tom
The effect of structural heterogeneity upon the microviscosity of ionic liquids.
Chemical science, 2020, 11, 6121-6133
1558121 CIFC24 H22 F6 N2 O4 S4P -113.7964; 14.4462; 14.8908
103.965; 99.568; 104.025
2713.5Clark, Ryan; Nawawi, Mohd A.; Dobre, Ana; Pugh, David; Liu, Qingshan; Ivanov, Aleksandar P.; White, Andrew J. P.; Edel, Joshua B.; Kuimova, Marina K.; McIntosh, Alastair J. S.; Welton, Tom
The effect of structural heterogeneity upon the microviscosity of ionic liquids.
Chemical science, 2020, 11, 6121-6133
1558122 CIFC22 H23 Cl2 I N2 S2P -17.9187; 12.1261; 13.0689
82.67; 78.619; 79.315
1203.5Clark, Ryan; Nawawi, Mohd A.; Dobre, Ana; Pugh, David; Liu, Qingshan; Ivanov, Aleksandar P.; White, Andrew J. P.; Edel, Joshua B.; Kuimova, Marina K.; McIntosh, Alastair J. S.; Welton, Tom
The effect of structural heterogeneity upon the microviscosity of ionic liquids.
Chemical science, 2020, 11, 6121-6133
1558123 CIFC21 H21 B0.43 F1.72 I0.57 N2 S2C 1 2/c 117.7575; 19.0198; 15.2682
90; 114.649; 90
4686.9Clark, Ryan; Nawawi, Mohd A.; Dobre, Ana; Pugh, David; Liu, Qingshan; Ivanov, Aleksandar P.; White, Andrew J. P.; Edel, Joshua B.; Kuimova, Marina K.; McIntosh, Alastair J. S.; Welton, Tom
The effect of structural heterogeneity upon the microviscosity of ionic liquids.
Chemical science, 2020, 11, 6121-6133
1558124 CIFC22 H21 F3 N2 O3 S3P 1 21/n 113.3057; 12.066; 14.7108
90; 108.185; 90
2243.81Clark, Ryan; Nawawi, Mohd A.; Dobre, Ana; Pugh, David; Liu, Qingshan; Ivanov, Aleksandar P.; White, Andrew J. P.; Edel, Joshua B.; Kuimova, Marina K.; McIntosh, Alastair J. S.; Welton, Tom
The effect of structural heterogeneity upon the microviscosity of ionic liquids.
Chemical science, 2020, 11, 6121-6133

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