Crystallography Open Database

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8104881 CIFC10 H16 N6 O19C 1 2/c 129.98; 8.4695; 20.719
90; 128.124; 90
4138.6Zheng, Yue; Lizhen, Chen; Hui, Chao; Chenglong, Wei; Zhihua, Li; Duanlin, Cao
The crystal structure of dipentaerthritol hexanitrate, C10H16N6O19
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 55-56
8104882 CIFC13 H11 N OP c a 2123.801; 6.051; 7.2677
90; 90; 90
1046.7Hosten, Eric C.; Betz, Richard
Crystal structure of N,N-diphenylformamide, C13H11NO
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 57-59
8104883 CIFC20 H14 F6 O2P 1 21/c 114.791; 8.5303; 15.531
90; 115.474; 90
1769.1Luan, Ming-Zhu; Wang, Hui-yun; Zhang, Mei; Song, Jia; Hou, Gui-Ge; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (E)-2-(3,5-bis(trifluoromethyl)benzylidene)-7-methoxy-3,4-dihydronaphthalen- 1(2H)-one, C20H14F6O2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 61-63
8104884 CIFC8 H8 O2P 43 21 210.9521; 10.9521; 23.3014
90; 90; 90
2795Maritz, Marius; Hosten, Eric C.; Betz, Richard
Crystal structure of ortho-methoxy benzaldehyde, C8H8O2 – a second polymorph and deposition of 3D coordinates
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 65-67
8104885 CIFC51 H79 O11 YP 1 21/c 18.8682; 22.1328; 27.9848
90; 96.71; 90
5455.2Zhong, Ke-Xiang; Zhang, Rong-Gui; Li, Lai-Chao; Zhao, De-Sen; Wang, Yan-Liang
Crystal structure of catena-poly[diaqua-bis(μ2-2-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)propanoato-κ2 O:O')-(2-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)propanoato-κ2 O,O')yttrium(III)], C51H79O11Y
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 69-72
8104886 CIFC8 H11 Cl N2 SP b c a11.3126; 8.3567; 20.413
90; 90; 90
1929.76Maritz, Marius; Hosten, Eric C.; Betz, Richard
Crystal structure of benzylthiouronium chloride, C8H11ClN2S
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 73-75
8104887 CIFC36 H32 Cl N3 O7P 21 21 2111.4608; 12.1489; 23.1684
90; 90; 90
3225.9Li, Wu-Wu; Gu, Yuan-Zi; Cao, Lei
Synthesis and crystal structure of tert-butyl (2′R,3R,3′R,4a′R,9a′S)-1-acetyl-5-chloro-3″-methyl-2,5″,9′-trioxo-1″-phenyl-1″,4a′,5″,9a′-tetrahydro-1′H,3′H,9′H-dispiro[indoline-3,4′-xanthene-2′,4″-pyrazole]-3′-carboxylate, C36H32ClN3O7
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 77-80
8104888 CIFC8 H8 O3P 1 21/c 16.3037; 33.102; 7.0471
90; 102.105; 90
1437.79Ndima, Lubabalo; Hosten, Eric C.; Betz, Richard
Crystal structure of 2-hydroxy-4-methoxy benzaldehyde, C8H8O3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 81-83
8104889 CIFC16 H12 Cd O10C 1 2/c 126.026; 6.3807; 19.738
90; 98.162; 90
3244.6Luo, Jie; Gu, Guang-Na; Zheng, Ying-Li
Crystal structure of poly[diaqua-(m3-3′,5′-dicarboxy-[1,1′-biphenyl]-3,4-dicarboxylato-K4 O,O′:O″:O‴) cadmium(II)], C16H11O10Cd
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 85-86
8104890 CIFC43 H78 Ca O22 S2P 1 21 118.2539; 15.3118; 18.3718
90; 91.2637; 90
5133.67Chang, Ying-Jie; Ding, Yuan-Min; Zhu, Lin-Yuan; Liu, Hong-Min; Li, Wen
Crystal structure of {tetraaqua-bis(1-(4-hydroxy-2-oxotetrahydrofuran-3-yl)-2-((4aS,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylenedecahydronaphthalen-1-yl)ethane-1-sulfonato-k2 O,O') calcium(II)}-{triaqua-bis(1-(4-hydroxy-2-oxotetrahydrofuran-3-yl)-2-((4aS,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylenedecahydronaphthalen-1-yl)ethane-1-sulfonato-k2 O,O') calcium(II)} – water – acetone (1/1/8/2)
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 87-91
8104891 CIFC65 H60 Br4 N8 O9 Zn2P -110.5707; 11.1159; 15.926
92.654; 104.446; 116.04
1601.9Song, Xiao-San
Synthesis and crystal structure of bis{2-bromo-6-((E)-((4-((E)-1-(methoxy-imino)ethyl)phenyl)imino)methyl)phenolato- κ 2 N,O}zinc(II)-methanol(1/2), C65H60Br4N8O9Zn2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 93-95
8104892 CIFC6 H6 O3 SP c a 2115.3524; 5.718; 15.3395
90; 90; 90
1346.58Manana, Pholani; Hosten, Eric C.; Betz, Richard
Crystal structure of benzenesulphonic acid
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 97-99
8104893 CIFC19 H15 N3 O2P 1 21/c 118.4336; 6.0321; 15.0585
90; 112.171; 90
1550.6Hosten, Eric C.; Betz, Richard
Crystal structure of N-benzyl-N-nicotinoyl-nicotine amide C19H15N3O2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 101-103
8104894 CIFC12 H18 Ag2 N4 O8 S2P 1 21/c 110.7841; 8.014; 11.722
90; 117.278; 90
900.4He, Ze-Rong; Zhao, Han-Lin; Jiang, Jin-Ke; Cheng, Hao-Feng; Cheng, Jie; Dong, Xian-Wu
Crystal structure of poly[aqua(μ3-2,4-diamino-benzenesulfonato-κ4 N:N ′,O:O′)silver(I)], C12H18O8N4S2Ag2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 105-106
8104895 CIFC26 H18 N6 Ni S4P -18.2947; 8.9964; 9.421
70.988; 79.971; 82.567
652.52Yan, Wei-Hong; Pan, Hui-Yan
Crystal structure of 1,4-bis(methylpyridinium benzene) bis(1,2-dicyanoethene-1,2-dithiolato-κ2 S:S)nickel(II), C26H18N6NiS4
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 107-108
8104896 CIFC23 H15 Cl Cu N4 O3P 1 21/c 110.63346; 17.99387; 11.6032
90; 116.216; 90
1991.74Yang, Qi; Hou, Meng-Qi; Chen, Pei-Rou; Li, Shuo; Zhou, Guang-Peng; Li, Gan; Chen, Dong-Dong
Crystal structure of the Cu(II) complex chlorido-(6-oxo-2-phenyl-1,6-dihydropyrimidine-4-carboxylato-k2 N,O)-(phenanthroline-k2 N,N')copper(II), C23H15ClCuN4O3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 109-111
8104897 CIFC14 H13 As Cl N O2P -17.718; 8.219; 11.962
87.438; 73.45; 72.167
691.66Averdunk, Arthur; Hosten, Eric C.; Betz, Richard
Crystal structure of phenarsazine chloride acetic acid solvate, C14H13AsClNO2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 113-115
8104898 CIFC27 H18 N O9 ZnP -18.4357; 10.1228; 13.5186
83.83; 84.306; 89.406
1142Luo, Jie; Wang, Xiao-Wei; Zheng, Ying-Li
Crystal structure of poly[aqua-(μ 2-3,3′,4,5′-biphenyl tetracarboxylate- κ 3 O,O′:O′′) -(μ 2-4,4′-bis(pyrid-4-yl)biphenyl-κ 2 N:N′)zinc(II)], C27H18NO9Zn
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 117-119
8104899 CIFC26 H24 Ag N3 O3 SP 1 21/c 113.1936; 11.0544; 16.3653
90; 99.214; 90
2356Liu, Xin; Zhao, Han-Lin; Jiang, Jin-Ke; Ma, Si-Yu; Li, Yong; Li, Yu-Jie
Crystal structure of catena-poly[(μ2-3-amino-benzenedisulfonato-κ2 N:O)-bis (3-methyl-isoquinoline-κN)silver(I)], C26H24N3O3SAg
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 121-123
8104900 CIFC8 H9 N O2 SP -16.6909; 7.9787; 8.5551
80.065; 68.175; 77.676
412.01Maritz, Marius; Hosten, Eric C.; Betz, Richard
Crystal structure of 2-((4-Aminophenyl)thio)acetic acid, C8H9NO2S
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 125-127
8104901 CIFC14 H15 As Cl N O SP 1 21 15.2852; 13.3035; 10.7522
90; 90.13; 90
756Averdunk, Arthur; Hosten, Eric C.; Betz, Richard
Crystal structure of phenarsazine chloride dimethylsulfoxide solvate, C14H15AsClNOS
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 129-131
8104902 CIFC8 H8 N4 OP 21 21 215.8085; 16.533; 18.171
90; 90; 90
1745Guerrab, Walid; Missioui, Mohcine; Zaoui, Younes; Mague, Joel T.; Ramli, Youssef
Synthesis and crystal structure of 2-azido-N-phenylacetamide, C8H8N4O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 133-134
8104903 CIFC30 H28 B Cl Cu N6P -111.549; 12.321; 12.348
111.785; 116.664; 97.513
1361.3Fujisawa, Kiyoshi; Shimizu, Masaya; Tiekink, Edward R. T.
Crystal structure of chlorido{hydridotris[3-phenyl-5-methylpyrazol-1-yl-κN 3]borato}copper(II), C30H28BClCuN6
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 135-138
8104904 CIFC17 H10 OP 21 21 215.0604; 14.672; 14.846
90; 90; 90
1102.3Manana, Pholani; Hosten, Eric C.; Betz, Richard
Crystal structure of benzanthrone – a redetermination for correct molecular geometry and localization of hydrogen atoms
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 139-141
8104905 CIFC7 H5 Br OP 1 21/c 127.3992; 3.9369; 12.8006
90; 103.504; 90
1342.6Ndima, Lubabalo; Cuthbertson, Jarryd; Hosten, Eric C.; Betz, Richard
Crystal structure of 4-bromobenzaldehyde – complete redetermination at 200 K, C7H5BrO
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 143-145
8104906 CIFC20 H30 B Cl Cu N8P 1 21/c 117.1345; 7.8207; 19.0213
90; 108.268; 90
2420.46Fujisawa, Kiyoshi; Tiekink, Edward R. T.
Crystal structure and spectroscopic properties of chlorido{hydridotris[3-,5-dimethylpyrazol-1-yl-κN 3]borato}(3-,5-dimethylpyrazol-1-yl-κN)copper(II), C20H30BClCuN8
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 147-150
8104907 CIFC22 H20 N2 OP n a 2111.677; 13.999; 11.171
90; 90; 90
1826.1Wang, Wenxiang; Zhu, Chao
The crystal structure of 4-((2-hydroxynaphthalen-1-yl)(pyrrolidin-1-yl)methyl)benzonitrile, C22H20N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 151-153
8104908 CIFC17 H15 N OC 1 2/c 119.197; 8.0719; 16.6511
90; 100.171; 90
2539.6Lin, Hui-Mei; Peng, Jia-Yin; Zou, Ting-Guang; Xu, Wan-Yi; Tao, Yi-Wen; Lai, Bao-Long
Crystal structure of 4-ethyl-3-phenylisoquinolin-1(2H)-one, C17H15NO
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 155-156
8104909 CIFC26 H40 Au F N O P SP 19.62498; 11.78239; 12.74349
78.7411; 73.5635; 76.6096
1335.34Yeo, Chien Ing; Tan, Yee Seng; Tiekink, Edward R. T.
Crystal structure of (tricyclohexylphosphane-κP)-[(Z)-N-(3-fluorophenyl)-O-methylthiocarbamato-k1 S]gold(I), C26H40AuFNOPS
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 157-161
8104910 CIFC32 H54 O4P 1 21 17.8727; 19.9173; 19.1801
90; 94.539; 90
2998.06Ma, Ying; Wang, Hui-Yun; Zhang, Xiao-Fan; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (3S,8R,10R,12R,14R)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate, C32H54O4
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 163-166
8104911 CIFC20 H19 N O2P 1 21 16.6856; 8.8783; 13.2398
90; 97.72; 90
778.75Gong, Yi-Xia; Geng, Yi-Ding
The crystal structure of 2-[(S)-1-(naphthalen-1-yl)ethyl]-2,3,7,7a- tetrahydro-3a,6-epoxyisoindol-1(6H)-one, C19H20NO2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 167-168
8104912 CIFC30 H52 B N6 TlP 1 21/n 19.611; 17.586; 19.71
90; 98.374; 90
3295.8Fujisawa, Kiyoshi; Shimizu, Daichi; Tiekink, Edward R. T.
Crystal structure of {hydridotris[3-(t-butyl)-5-isopropylpyrazol-1-yl-κN 3]borato}thallium(I), C30H52BN6Tl
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 169-172
8104913 CIFC22 H26 N2 OC 1 2/c 147.4887; 5.022; 16.4551
90; 108.993; 90
3710.7Abad, Nadeem; Ferfra, Souad; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef
Synthesis and crystal structure of 1-octyl-3-phenylquinoxalin-2(1H)-one, C22H26N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 173-175
8104914 CIFC6 H4 F2 OP 21 21 214.9287; 10.1752; 10.9156
90; 90; 90
547.42Manana, Pholani; Cuthbertson, Jarryd; Hosten, Eric C.; Betz, Richard
The crystal structure of 2,6-difluorophenol, C6H4F2O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 177-178
8104915 CIFC18 H20 Br N OP b c a8.4285; 19.2055; 19.7809
90; 90; 90
3202Kailani, Mohammed H.; Awwadi, Firas F.
4-(9H-Fluoren-9-yl)-4-methylmorpholin-4-ium bromide, C18H20BrNO
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 179-180
8104916 CIFC5 H10 N2 OI 1 a 14.7212; 11.1424; 12.8211
90; 94.349; 90
672.52Hosten, Eric C.; Betz, Richard
The crystal structure of 2,4-dimethylimidazole monohydrate, C5H10N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 181-183
8104917 CIFC5 H8 N2P 1 21/n 18.2492; 7.2496; 9.2882
90; 99.214; 90
548.3Hosten, Eric C.; Betz, Richard
The crystal structure of 1,2-dimethylimidazole, C5H8N2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 185-186
8104918 CIFC7 H8 N2 O2P 1 21/n 18.9884; 6.049; 12.129
90; 95.4; 90
656.54Hosten, Eric C.; Betz, Richard
The crystal structure of 3-ammonio-4-aminobenzoate, C7H8N2O2 – a second polymorph
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 187-188
8104919 CIFC14 H15 Cl N4 O5 S2P b c a16.1956; 11.7856; 18.7814
90; 90; 90
3584.9Miao, Ming-zhi; Li, Ji
The crystal structure of 4-hydroxy-2,5-bis(1-methyl-1H-imidazol-3-ium-2-ylthio)-3,6-dioxocyclohexa-1,4-dienolate chloride monohydrate, C14H15N4O5S2Cl
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 189-191
8104920 CIFC14 H16 Fe OP 21 21 215.6954; 10.0307; 20.4422
90; 90; 90
1167.84Hosten, Eric C.; Betz, Richard
The crystal structure of butyrylferrocene, C14H16FeO
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 193-195
8104921 CIFC10 H18 O2C 1 2/c 110.0025; 18.8285; 11.2384
90; 115.327; 90
1913.11Hosten, Eric C.; Betz, Richard
The crystal structure of bi-1,1′-cyclopentane-1,1′-diol, C10H18O2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 197-199
8104922 CIFC6 H10 N2P -17.4423; 7.942; 11.6711
96.667; 95.65; 100.999
667.42Hosten, Eric C.; Betz, Richard
The crystal structure of 2-iso-propylimidazole, C6H10N2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 201-203
8104923 CIFC45 H35 La O7R 3 :H22.3832; 22.3832; 6.4522
90; 90; 120
2799.5Hickson, Matthew; Sephton, Abigail; Dugmore, Travis; Hosten, Eric C.; Betz, Richard
The crystal structure of aqua-tris (1,3-diphenylpropane-1,3-dionato-κ2 O,O′)-lanthanum(III), C45H35LaO7
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 205-207
8104924 CIFC24 H21 F6 N O3P 1 21/c 116.6493; 15.3005; 8.8554
90; 99.746; 90
2223.3Zhang, Xiao-Fan; Wang, Hui-yun; Song, Jia; Liang, Lun-Hai; Xu, Yang-Rong; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (3E,5E)-3,5-bis-4-methoxy-3-(trifluoromethyl)benzylidene)-1-methylpiperidin-4-one, C24H21F6NO3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 209-211
8104925 CIFC6 Cl2 N4 O5P 21 21 216.0044; 8.966; 18.0544
90; 90; 90
971.97Wang, Haifang
The crystal structure of 3,5-dichloro-6-diazo-2,4-dinitrocyclohexa-2,4-dien-1-one, C6Cl2N4O5
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 213-214
8104926 CIFC29 H23 As N O2 RhP -19.2778; 9.8274; 14.444
99.748; 91.33; 114.197
1177.6Elmakki, Mohammed A.; Alexander, Orbett T.; Venter, Johan A.; Roodt, Andreas
Crystal structure of carbonyl(2-methylquinolin-8-olato-κ2 N,O)(triphenylarsine-κAs)rhodium(I), C29H23AsNO2Rh
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 215-217
8104927 CIFC22 H25 N O5P 1 21/c 115.7241; 7.0223; 18.4613
90; 100.329; 90
2005.4Luo, Jiahuan; Zhai, Shengxian; Han, Chuchu; Zhao, Hanwen
Crystal structure of (1aS,1a 1 S,2S)-4a-butoxy-1a,1a 1,2,4a,5,6-hexahydro-1H-cyclobuta[de]naphthalen-2-yl-4-nitrobenzoate, C22H25NO5
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 219-221
8104928 CIFC24 H19 As N O3 RhP -19.1358; 9.6478; 12.4509
92.303; 106.281; 99.137
1035.89Elmakki, Mohammed A.; Alexander, Orbett T.; Venter, Johan A.; Roodt, Andreas
Crystal structure of carbonyl(2-oxopyridin-1(2H)-olato-k2 O,O′)(triphenylarsine-κAs)rhodium(I), C24H19AsNO3Rh
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 223-225
8104929 CIFC14 H24 Ba N12 O15C 1 2/c 121.787; 6.7594; 18.143
90; 102.456; 90
2609Xie, Wei; Li, Rui; Wang, Chuan-Qi
Crystal structure of catena-poly[triqua-bis(μ 2-4-carboxy-2-(1H-tetrazol-1-yl)-1H-imidazole-5-carboxylato-k3 N,O:O′)barium(II)] tetrahydrate, C14H14BaN12O15
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 227-229
8104930 CIFC35 H32 N6 O2P -110.902; 12.434; 13.481
102.881; 104.935; 114.542
1488.7Liu, Shuang-Shuang; Wu, Wei-Na; Wang, Yuan
Crystal structure of (E)-3′,6′-bis(ethylamino)-2-((quinoxalin-2-ylmethylene)amino)spiro[isoindoline-1,9′-xanthen]-3-one, C35H32N6O2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 231-233
8104931 CIFC52 H40 Cl4 N4 O16 Pb2P -19.1186; 12.8031; 13.0111
63.504; 79.4; 77.198
1319.34Tang, Zhiwei; Wen, Decai
Crystal structure of diaqua-bis(μ2-5-chloro-salicylato-κ3 O,O′:O′)-bis(5-chloro-salicylato-κ2 O,O′)-bis(1,10-phenanthroline-κ2 N,N′) dilead(II) – water (1/2), C52H36C14N4O14Pb2·2(H2O)
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 235-237
8104932 CIFC31 H29 N3 O7P 1 21/c 113.628; 14.4801; 14.4962
90; 97.586; 90
2835.6Zhang, Ling; Wu, Wei-Na; Wang, Yuan
Crystal structure of (E)-2-(4-ethoxycarbonyl-3,5-dimethyl-2-(pyrrole-2-ylmethyleneamino)-3′,6′-dihydroxylspiro[isoindoline-1,9′-xanthen]-3-one-methanol (1/1), C31H29N3O7
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 239-241
8104933 CIFC14 H9 N O2P c a 2127.19; 4.3317; 17.297
90; 90; 90
2037.2Wang, Li-Hua; Zhou, Xiao-Jing; Liu, Li-Li; Zhang, Ai-Ling; Tai, Xi-Shi
The crystal structure of 5H-dibenzo[b,e]azepine-6,11-dione, C14H9NO2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 243-244
8104934 CIFC19 H14 F4 O2C 1 2/c 117.1519; 13.981; 15.2299
90; 123.031; 90
3061.9Luan, Ming-Zhu; Wang, Hui-Yun; Zhang, Mei; Song, Jia; Xu, Yang-Rong; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (E)-2-(4-fluoro-2-(trifluoromethyl)benzylidene)-7-methoxy-3,4-dihydronaphthalen-1(2H)-one, C19H14F4O2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 245-247
8104935 CIFC25 H20 N2 O2 Se2P -19.605; 9.7531; 13.2788
75.13; 81.824; 72.329
1142.75Wang, Lu-Yao; Wang, Qing; Zhang, Meng-Meng; Li, Ping-Ping; Guo, Xiao-Long
The crystal structure of N-(2-methoxy-4,5-bis[phenylselanyl]phenyl)picolinamide, C25H20N2O2Se2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 249-250
8104936 CIFC14 H14 Br N3 O3P c a 2132.932; 5.849; 7.3606
90; 90; 90
1417.8Li-Hua, Wang; Xiao-Jing, Zhou; Li-Li, Liu; Ai-Ling, Zhang; Xi-Shi, Tai
The crystal structure of (E)-2-(5-bromo-2-hydroxybenzylidene)-N-phenylhydrazine-1- carboxamide monohydrate, C14H14BrN3O3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 251-252
8104937 CIFC13 H10 N3 O6 ReP 1 21/c 17.9325; 13.8112; 13.4577
90; 92.637; 90
1472.8Jacobs, Francois J. F.; Brink, Alice
Crystal structure of fac-tricarbonyl-(nitrato-k1 O)-bis(pyridine-κN)-rhenium, C13H10O6N3Re
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 253-255
8104938 CIFC27 H25 N3 O6P -110.591; 10.833; 12.503
73.69; 88.569; 60.856
1191.7Song, Yu-Fei; Wu, Wei-Na; Wang, Yuan
Crystal structure of (E)-2-(((1H-pyrrol-2-yl)methylene)amino)-3′,6′-dihydroxyspiro[isoindoline-1,9′-xanthen]-3-one — methanol (1/2), C27H25N3O6
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 257-258
8104939 CIFC14 H16 N4 O3P 21 21 28.0968; 16.6829; 5.3097
90; 90; 90
717.22Xi-Shi, Tai; Xiao-Jing, Zhou; Li-Li, Liu; Ai-Ling, Zhang; Li-Hua, Wang
The crystal structure of 4-amino-N′-(4-aminobenzoyl)benzohydrazide monohydrate, C14H16N4O3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 259-260
8104940 CIFC12 H20 N8 O6 S2P 1 21/c 115.8571; 7.6581; 16.9166
90; 113.334; 90
1886.3Chen, Kun; Shi, Yanmei; Zhu, Xin
Crystal structure of bis(amino(carbamothioylamino)methaniminium) 5-hydroxyisophthalate monohydrate, C12H20N8O6S2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 261-262
8104941 CIFC6 H6 Cl NP 1 21/c 16.5211; 10.2467; 9.1436
90; 94.1771; 90
609.35Hosten, Eric C.; Betz, Richard
The crystal structure of 2-(chloromethyl)pyridine, C6H6ClN
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 263-265
8104942 CIFC6 H4 Br IP 1 21/c 14.1704; 5.8242; 14.929
90; 97.315; 90
359.66Hosten, Eric C.; Betz, Richard
The crystal structure of 1-bromo-4-iodo-benzene, C6H4BrI
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 267-268
8104943 CIFC8 H9 N O3P 1 21/n 16.9121; 26.97; 8.7204
90; 106.152; 90
1561.48Hosten, Eric C.; Betz, Richard
The crystal structure of 2,6-dimethyl-4-nitro-phenol, C8H9NO3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 269-271
8104944 CIFC3 H5 Cl O2P 1 21/c 15.2011; 7.4362; 24.1175
90; 94.594; 90
929.78Hosten, Eric C.; Betz, Richard
The crystal structure of 3-chloropropionic acid, C3H5ClO2
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 273-275
8104945 CIFC9 H10 O3P b c a14.257; 7.925; 29.8796
90; 90; 90
3376Hosten, Eric C.; Betz, Richard
The crystal structure of 2-(2-methoxyphenyl)acetic acid, C9H10O3
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 277-279
8104946 CIFC17 H15 N O3P 1 21/n 14.397; 13.8942; 22.0484
90; 91.099; 90
1346.75Zhang, Sheng-Nan; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (E)-7-hydroxy-2-((6-methoxypyridin-3-yl)methylene)-3, 4-dihydronaphthalen-1(2H)-one, C17H15NO3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1-3
8104947 CIFC18 H17 N O3P -17.4638; 8.0392; 12.6767
108.187; 94.029; 95.071
715.95Ma, Guang-Qun; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (E)-7-methoxy-2-((2-methoxypyridin-3-yl)methylene)-3,4-dihydronaphthalen-1 (2H)-one, C18H17NO3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 5-7
8104948 CIFC20 H16 N6P 1 21/c 17.6623; 11.8206; 8.896
90; 91.825; 90
805.33Sun, Yue; Yang, Tianyu; Wang, Wenxiang
The crystal structure of N 6,N 6′-di(pyridin-2-yl)-[2,2′-bipyridine]-6,6′-diamine, C20H16N6
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 9-11
8104949 CIFC64 H64 Br2 Cl4 N2 NiC 1 2/c 131.9723; 11.9826; 18.4722
90; 125.038; 90
5794.4Guo, Kun-Peng
The crystal structure of {N 1,N 2-bis[2,4-dimethyl-6-(4-(tert-butyl)phenyl)(phenyl)methyl]acenaphthylene-1,2-diimino-κ2 N, N′}-dibromido-nickel(II) – dichloromethane(1/2), C64H64Br2Cl4N2Ni
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 13-15
8104950 CIFC25.71 H32.57 N9.86 O15 P3 Ru3 S3P 6337.24213; 37.24213; 11.64828
90; 90; 120
13991.4Ebong, Wisdom; Muniz, Alexandra E.; Khan, David R.; Unruh, Daniel K.; Yarbrough, Jason C.
Synthesis and crystal structure of nonacarbonyltris[(2-thia-1,3,5-triaza-7-phosphatricylco[3.3.1.1]decane-κ1 P)-2,2-dioxide]triruthenium(0) – acetonitrile (7/6), C25.71H32.57N9.86O15P3S3Ru3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 17-21
8104951 CIFC13 H9 N3 O2P 1 21/c 13.7375; 27.968; 10.2595
90; 95.512; 90
1067.47Ibrahim, Halliru; Zamisa, Sizwe J.; Bala, Muhammad D.; Friedrich, Holger B.
A new polymorph of 1-(4-nitrophenyl)-1H-benzimidazole (C13H9N3O2)
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 23-25
8104952 CIFC26 H22 N2 O2P 1 21/n 16.2362; 16.3148; 20.0521
90; 94.308; 90
2034.38Ndlangamandla, Nqobile; Clayton, Hadley S.
The crystal structure of 2,2′-((1E,1′E)-(naphthalene-2,3 diylbis(azanylylidene)) bis(methanylylidene))bis(4-methylphenol), C26H22N2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 27-29
8104953 CIFC12 H12 I4 Os2P b c a11.972; 10.4991; 13.281
90; 90; 90
1669.36Tapala, Kgaugelo C.; Clayton, Hadley S.
The crystal structure of bis(μ2-iodido)-bis(η6-benzene)-bis(iodido)-diosmium(II), C12H12I4Os2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 31-32
8104954 CIFC30 H44 B2 Cu N12P -18.6801; 10.1688; 10.729
62.672; 84.355; 78.97
825.71Fujisawa, Kiyoshi; Okamura, Moemi; Tiekink, Edward R. T.
Redetermination of the crystal structure of bis{hydridotris(3,5-dimethylpyrazol-1-yl-κN 3)borato}copper(II), C30H44B2CuN12
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 33-36
8104955 CIFC15 H20 O2 SP 1 21/c 112.852; 10.5864; 11.2202
90; 104.375; 90
1478.79Dong, Le; Guo, Ya-Fei; Ma, Jun-Ying; Wang, Jun-Ling; Feng, Shu-Xiao; Huo, Hui-Kang
Crystal structure of (E)-3-((4-(tert-butyl)phenyl)thio)-4-hydroxypent-3-en-2-one, C15H20O2S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 37-39
8104956 CIFC23 H21 N O2C 1 2/c 120.163; 10.1693; 8.8032
90; 95.992; 90
1795.2Li, Yameng; Xu, Yongquan; Zhang, Ziwen; Li, Nan; Bai, Xiaofan; He, Jingyu; Wu, Haixia
Crystal structure of 2,2′-(p-tolylazanediyl)bis(1-phenylethan-1-one), C23H21NO2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 41-43
8104957 CIFC132 H98 I12 N34 O20 Zn6P 1 21/c 134.978; 15.02541; 30.13247
90; 101.903; 90
15495.9Eigner, Václav
Redetermination of the crystal structure of the crystal sponge the poly[tetrakis(μ3-2,4,6-tris(pyridin-4-yl)-1,3,5-triazine)-dodecaiodidohexazinc(II) nitrobenzene solvate], C72H48I12N24Zn6⋅10(C6H5NO2)
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 45-49
8104958 CIFC44 H45 N5 O2P -111.214; 11.9932; 14.2703
98.879; 102.025; 91.122
1851.97Li, Kaihao; Wu, Jinping; Lan, Hairong; Wang, Junmin; Yuan, Juan
Crystal structure of (4′E)-6′-(diethylamino)-2-[(E)-[(6-methylpyridin-2-yl)methylidene]amino]-4′-{2-[(2E)-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene]ethylidene}-1′,2,2′,3,3′,4′-hexahydrospiro[isoindole-1,9′-xanthene]-3-one, C44H45N5O2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 51-54
8104959 CIFC17 H12 F2 OP -17.3632; 8.6467; 11.3278
87.633; 88.022; 65.364
654.88Song, Jia; Zhao, Feng-Lan; Wang, Qi-bao; Meng, Qing-Guo
Crystal structure of (E)-7-fluoro-2-(3-fluorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one, C17H12F2O1
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 55-57
8104960 CIFC26 H54 N10 O3 S3P 1 c 18.5247; 10.6658; 21.297
90; 109.472; 90
1825.63Xu, Duanjie; Wang, Baiyan; Zhu, Xin
Crystal structure of tetrabutylammonium sulfanilate – 1-(diaminomethylene)thiourea (1/2)
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 59-60
8104961 CIFC21 H19 Cl4 Fe N4 O2 SP 1 21/c 116.304; 11.1675; 14.1041
90; 109.322; 90
2423.4Duan, Rui; Guojun, Yu; Tian, Hui; Wang, Man; Wu, Qiong
Crystal structure of [2,2′-{azanediyl)bis[(propane-3,1-diyl)(azanylylidene)methylylidene]} bis(3,5-dichlorophenolato)-κ2O,O′]-isothiocyanato-κN-iron(III), C21H19Cl4FeN4O2S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 61-63
8104962 CIFC13 H9 Cl O2P 1 21 16.5465; 8.0647; 10.8476
90; 105.591; 90
551.63Bai, Xiao-Hui; Xing, Yan; Liu, Si-Jie
Crystal structure of (4-chlorophenyl)(4-hydroxyphenyl)methanone, C13H9ClO2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 65-66
8104963 CIFC19 H16 Br4 Cu N2 O2P 1 21/c 110.2649; 10.1903; 21.2494
90; 100.522; 90
2185.36Duan, Rui; Man, Wang; Meifen, Huang; Ma, Xun; Wu, Qiong
Crystal structure of 6,6′-((pentane-1,3-diylbis(azaneylylidene))bis(methaneylylidene))bis(2,4-dibromolphenolato-κ4 N,N′,O,O′)copper(II),) C19H16Br4CuN2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 67-69
8104964 CIFC20 H24 Cl Mn N2 O5P -19.7567; 9.7786; 11.6712
69.227; 89.459; 73.849
995.1Zheng, Liping; Wang, Jialu; Jiao, Haolong; Meng, Licha; Qiao, Yongfeng
Chlorido-(2,2′-(ethane-bis(5-methoxyphenolato))-κ4 N,N′,O,O′)manganese(III) monohydrate, C19H18Cl2CuN2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 71-73
8104965 CIFC22 H28 O2P n a 2112.0841; 16.6946; 9.3837
90; 90; 90
1893.1Guo, Wei; Zhai, Pengda; Bai, Xiaofan; Li, Nan; Wu, Haixia; Zhang, Zhihui; He, Jingyu
Crystal structure of 2,6-di-tert-butyl-4-(4-methoxybenzylidene)cyclohexa-2,5-dien-1-one, C22H28O2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 75-77
8104966 CIFC19 H18 Cl2 Cu N2 O2C 1 2/c 121.01; 11.3886; 7.9578
90; 100.725; 90
1870.8Duan, Rui; Ma, Xun; Huang, Meifen; Wang, Man; Wu, Qiong
Crystal structure of [6,6′-(((2,2-dimethylpropane-1,3-diyl)bis(azanylylidene))bis(methanylylidene))bis(2-chlorophenolato)-κ4N,N′,O,O′]copper(II)
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 79-80
8104967 CIFC30 H20 Cl2 N2 O4 S2P c a 2116.9808; 7.5227; 20.8027
90; 90; 90
2657.4Jia, Li-Mei; Luo, Peng; Pan, Wei-Gao
Crystal structure of 2-chloro-3-((thiophen-2-ylmethyl)amino)naphthalene-1,4-dione, C30H20O4N2Cl2S2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 81-83
8104968 CIFC30 H26 B2 F18 Mn N12P -110.5322; 10.6475; 10.989
111.755; 99.1; 112.74
988.07Ikarugi, Riko; Fujisawa, Kiyoshi; Tiekink, Edward R. T.
Crystal structure of bis{hydridotris(3-trifluoromethyl-5-methylpyrazolyl-1-yl)borato-κN 3}manganese(II), C30H26B2F18MnN12
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 85-87
8104969 CIFC21 H14 F6 SP 1 21/n 19.9344; 16.7106; 11.6207
90; 101.008; 90
1893.7Jiang, Duohua
Crystal structure of 1-(2-methylphenyl)-2-(2-methylbenzo[b]thienyl)-3,3,4,4,5,5-hexafluorocyclopent-ene, C21H14F6S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 89-91
8104970 CIFC10 H17 F6 N4 O P S2P 21 21 218.7848; 9.8894; 18.802
90; 90; 90
1633.5Eigner, Václav; Holakovský, Roman
Crystal structure of 2-(3-((carbamimidoylthio)methyl)benzyl)isothiouronium hexafluorophosphate monohydrate, C10H17F6N4OPS2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 93-95
8104971 CIFC21 H23 Cl4 I2 N3P 1 21/c 126.11; 9.1149; 33.793
90; 134.138; 90
5771.7Xu, Xingyu; Qiu, Ping
Crystal structure of 4,5-diiodo-1,3-dimesityl-1H-1,2,3-triazol-3-ium chloride – chloroform (1/1), C21H23Cl4I2N3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 97-99
8104972 CIFC21 H23 Br4 Co N6 O3P 1 21/c 116.23; 20.9661; 7.8269
90; 97.225; 90
2642.19Duan, Rui; Tian, Hui; Guojun, Yu; Wu, Qiong
Crystal structure of azido-k1 N-{6,6′-((((methylazanediyl)bis(propane-3,1-diyl))bis(azanylylidene))bis(methanylylidene))bis(2,4-dibromophenolato)k5 N,N′,N″,O,O′}cobalt(III)-methanol (1/1)), C21H23Br4CoN6O3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 101-103
8104973 CIFC10 H17 F6 N4 O P S2P 1 21/c 113.0455; 12.6114; 10.7642
90; 99.546; 90
1746.4Eigner, Václav; Holakovský, Roman
The crystal structure of 2-(4-((carbamimidoylthio)methyl)benzyl)isothiouronium hexafluorophosphate monohydrate, C10H17F6N4OPS2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 105-107
8104974 CIFC9 H14 F12 N4 P2P 1 21/m 15.8968; 11.5554; 12.994
90; 94.577; 90
882.6Huang-Xian, Zhang; Kun, Yuan; Qi-Long, Du; Xu-Liang, Nie; Wan-Ming, Xiong
Crystal structure of 1,1′-(methane-1,1-diyl)bis(3-methyl-1H-imidazol-3-ium) bis(hexafluoridophosphate), C9H14F12N4P2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 109-111
8104975 CIFC54 H48 N4 O2P -111.1883; 13.5364; 14.3412
105.885; 97.71; 94.126
2056.64Wu, Jinping; Li, Kaihao; Lan, Hairong; Chu, Yixin
Crystal structure of (4′E)-6′-(diethylamino)-2-[(E)-[(pyren-1-yl)methylidene]amino]-4′-{2-[(2E)-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene]ethylidene}-1′,2,2′,3,3′,4′-hexahydrospiro[isoindole-1,9′-xanthene]-3-one, C54H48N4O2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 113-116
8104976 CIFC24 H18 Cu N12 S2P 1 21/c 111.038; 8.9312; 16.083
90; 125.66; 90
1288.2Li, Lu; Duan, Huajian; Qian, Jun
Crystal structure of poly[bis(μ2-2,6-bis(1-imidazoly)pyridine-κ2 N,N′)-bis(thiocyanato-κ1 N)copper(II)] dithiocyanate, C24H18CuN12S2
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 117-119
8104977 CIFC21 H33 Cl9 Fe2 N12 O9R -3 :H13.1897; 13.1897; 39.5222
90; 90; 120
5954.4Reiss, Guido J.; Wyshusek, Maik
Cones with a three-fold symmetry constructed from three hydrogen bonded theophyllinium cations that coat [FeCl4]− anions in the crystal structure of tris(theophyllinium) bis(tetrachloridoferrate(III)) chloride trihydrate, C21H33Cl9Fe2N12O9
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 121-124
8104978 CIFC32 H49 N3 O6 SP 21 21 219.2618; 12.4066; 27.2256
90; 90; 90
3128.42Liu, Si-Jie; Fan, Yuan; Shang, Ruofeng
Crystal structure of 14-O-[(4-(4-hydroxypiperidine-1-yl)-6-methylpyrimidine-2-yl)thioacetyl]-mutilin monohydrate, C32H49N3O6S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 125-127
8104979 CIFC13 H12 Cl N3F d d 228.776; 41.7393; 8.5929
90; 90; 90
10320.8Sun, Guo-Xiang; Min, Li-Jing; Han, Liang; Liu, Xing-Hai
The crystal structure of (E)-3-chloro-2-(2-(4-methylbenzylidene)hydrazinyl)pyridine, C13H12ClN3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 129-131
8104980 CIFC16 H15 N3 O3P 1 21/c 19.4957; 18.2275; 9.0896
90; 114.372; 90
1433.05Setshedi, Itumeleng B.; Smith, Mark G.
The crystal structure of 4-phenyl-4-[2-(pyridine-4-carbonyl)hydrazinylidene]butanoic acid, C16H15N3O3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 133-134

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