Crystallography Open Database

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1520378 CIFC22 H18 N2 O4 Pd2 S2P 1 21/n 19.5853; 19.1332; 12.3889
90; 103.732; 90
2207.15Spencer, John; Callear, Samantha K.; Hursthouse, Michael B.
C22H18N2O4Pd2S2
Crystal Structure Report Archive, 2009, 708
1520390 CIFC20 H26 O4 S2 Se2P 1 21/n 113.0885; 12.5754; 14.4854
90; 110.753; 90
2229.5Wirth, Thomas; Callear, Samantha K.; Hursthouse, Michael B.
C20H26O4S2Se2
Crystal Structure Report Archive, 2009, 653
1520391 CIFC37 H60 Cl Fe O4 P2 RhP b c a16.8121; 19.229; 22.968
90; 90; 90
7425.1Coles, Simon J.; Hursthouse, Michael B.; Butler, I. R.
C37H60ClFeO4P2Rh
Crystal Structure Report Archive, 2009, 654
1520392 CIFC14 H21 Cl N3 P Pd SP 1 21/c 16.2066; 17.196; 15.1712
90; 90.442; 90
1619.15Spencer, John; Callear, Samantha K.; Hursthouse, Michael B.
C14H21ClN3PPdS
Crystal Structure Report Archive, 2009, 655
1520393 CIFC18 H28 I2 N4 O2P 21 21 218.9301; 10.8793; 23.2605
90; 90; 90
2259.83Dervisi, A.; Callear, Samantha K.; Hursthouse, Michael B.
C18H28I2N4O2
Crystal Structure Report Archive, 2009, 658
1520394 CIFC13 H17 Cl N2 O3 SiP 1 21/c 18.8936; 22.0632; 7.8946
90; 106.318; 90
1486.69Taylor, P. G.; Callear, Samantha K.; Hursthouse, Michael B.
C13H17ClN2O3Si
Crystal Structure Report Archive, 2009, 659
1520395 CIFC25 H45 B1.88 Br0.12 F3.52 O2 PP 1 21/n 112.248; 9.1264; 25.8185
90; 96.561; 90
2867.09Spencer, John; Callear, Samantha K.; Hursthouse, Michael B.
C25H45B1.88Br0.12F3.52O2P
Crystal Structure Report Archive, 2009, 661
1520396 CIFC9 H12 Cl2 N2 O3 SiC 1 c 110.6695; 17.3082; 7.7714
90; 116.56; 90
1283.7Taylor, P. G.; Callear, Samantha K.; Hursthouse, Michael B.
C9H12Cl2N2O3Si
Crystal Structure Report Archive, 2009, 662
1520397 CIFC16 H21 Cl N4 O7 SiP 1 21/c 124.2668; 6.9038; 23.7477
90; 93.232; 90
3972.2Taylor, P. G.; Callear, Samantha K.; Hursthouse, Michael B.
C16H21ClN4O7Si
Crystal Structure Report Archive, 2009, 663
1520398 CIFC32 H31 N O2 P Pd SP 1 21/c 19.4839; 11.0427; 26.077
90; 95.022; 90
2720.5Spencer, John; Callear, Samantha K.; Hursthouse, Michael B.
C32H31NO2PPdS
Crystal Structure Report Archive, 2009, 664
1520399 CIFC10 H6 F N3 OP 1 21/n 18.1049; 6.1023; 17.6777
90; 92.219; 90
873.66Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C10H6FN3O
Crystal Structure Report Archive, 2009, 705
1520400 CIFC8 H8 Cl N OP b c a10.5174; 9.4252; 16.2656
90; 90; 90
1612.39Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(2-chlorophenyl)acetamide
Crystal Structure Report Archive, 2009, 1368
1520401 CIFC9 H8 N2 OP 1 21/n 17.0527; 12.7252; 9.6648
90; 111.315; 90
808.05Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(3-cyanophenyl)acetamide
Crystal Structure Report Archive, 2009, 1377
1520402 CIFC10 H11 N O2P -15.5061; 7.2607; 11.4567
103.709; 93.064; 100.528
435.23Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(3-acetylphenyl)acetamide
Crystal Structure Report Archive, 2009, 1378
1520403 CIFC9 H8 N2 OC 1 c 13.8456; 22.19; 9.448
90; 90.048; 90
806.2Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(4-cyanophenyl)acetamide
Crystal Structure Report Archive, 2009, 1401
1520404 CIFC15 H24 N2 O2P 1 21/c 114.477; 11.2719; 9.0254
90; 102.352; 90
1438.7Wirth, Thomas; Callear, Samantha K.; Hursthouse, Michael B.
C15H24N2O2
Crystal Structure Report Archive, 2009, 633
1520405 CIFC10 H10 La2 O16 S2 W2P 1 21/c 117.1242; 7.4638; 7.6228
90; 91.048; 90
974.12Fogg, Andrew; Nicholls, Jennifer; Callear, Samantha K.; Hursthouse, Michael B.
C10H10La2O16S2W2
Crystal Structure Report Archive, 2009, 639
1520406 CIFC7 H16 O2P 1 21/c 112.1273; 11.4724; 11.5592
90; 90.735; 90
1608.09Gillott, D.; Callear, Samantha K.
2,2-diethyl-1,3-propanediol
Crystal Structure Report Archive, 2009, 642
1520407 CIFC17 H26 B N O3P 1 21/c 16.463; 12.9251; 20.862
90; 93.69; 90
1739.1Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C17H26BNO3
Crystal Structure Report Archive, 2009, 649
1520408 CIFC13 H13 Cl2 N4 O6 SiP 1 21/n 110.2948; 12.6066; 14.3449
90; 109.01; 90
1760.18Taylor, P. G.; Callear, Samantha K.; Stephenson, Richard; Hursthouse, Michael B.
C13H13Cl2N4O6Si
Crystal Structure Report Archive, 2009, 660
1520409 CIFC11 H24 O2P -19.441; 10.7119; 13.1912
73.838; 86.183; 70.395
1206.51Addy, D.; Callear, Samantha K.
2,2-dibutyl-1,3-propanediol
Crystal Structure Report Archive, 2009, 643
1520410 CIFC10 H14 N4 OP 1 21/c 115.1518; 6.1889; 11.279
90; 109.004; 90
1000.02Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C10H14N4O
Crystal Structure Report Archive, 2009, 634
1520411 CIFC15 H15 F N4 OP 21 21 216.1453; 7.8485; 27.6153
90; 90; 90
1331.92Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C15H15FN4O
Crystal Structure Report Archive, 2009, 635
1520412 CIFC14 H17 N5 OP 1 21/c 113.5783; 8.2142; 12.6554
90; 103.051; 90
1375.06Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C14H17N5O
Crystal Structure Report Archive, 2009, 636
1520413 CIFC13 H14 N4 O SP 1 21 16.2194; 7.6717; 13.7114
90; 101.551; 90
640.97Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C13H14N4OS
Crystal Structure Report Archive, 2009, 637
1520414 CIFC9 H14 O3P 1 21/n 15.8119; 12.94; 11.9303
90; 95.045; 90
893.75Motherwell, W.; Callear, Samantha K.; Hursthouse, Michael B.
C9H14O3
Crystal Structure Report Archive, 2009, 638
1520415 CIFC20 H20 La4 O32 S4 W4P -17.255; 8.111; 16.931
80.408; 78.681; 89.674
962.9Fogg, Andrew; Nicholls, Jennifer; Callear, Samantha K.; Hursthouse, Michael B.
C20H20La4O32S4W4
Crystal Structure Report Archive, 2009, 640
1520416 CIFC22 H25 Cl N5 O P PdP -18.8363; 10.2749; 11.6567
86.643; 86.468; 86.435
1052.69Spencer, John; Callear, Samantha K.; Hursthouse, Michael B.
C22H25ClN5OPPd
Crystal Structure Report Archive, 2009, 641
1520417 CIFC16 H23 N4 OP 1 21/n 110.5278; 5.3937; 27.1476
90; 94.292; 90
1537.22Spencer, John; Patel, Hiren; Callear, Samantha K.
C16H23N4O
Crystal Structure Report Archive, 2009, 646
1520418 CIFC16 H17 F N4 OP 1 21/c 115.865; 5.6205; 16.4742
90; 106.779; 90
1406.45Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C16H17FN4O
Crystal Structure Report Archive, 2009, 647
1520419 CIFC13 H15 Cl N2 O2 SiP b c a11.8719; 15.0801; 15.5429
90; 90; 90
2782.64Taylor, P. G.; Callear, Samantha K.; Hursthouse, Michael B.
C13H15ClN2O2Si
Crystal Structure Report Archive, 2009, 651
1520420 CIFC12 H6 N4P 1 21/c 13.7477; 10.0209; 12.8933
90; 91.718; 90
483.99Coles, Simon J.; Hursthouse, Michael B.; Sengul, Abdurrahaman
2,2'Bipyridyl-3,3'dicarbonitrile
Crystal Structure Report Archive, 2009, 624
1520421 CIFC10 H21 Cl3 N6 OP -18.9934; 10.0238; 10.5796
97.045; 107.44; 116.265
778.78Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C10H21Cl3N6O
Crystal Structure Report Archive, 2009, 626
1520422 CIFC15 H17 N3 O2 SP 21 21 218.1593; 15.423; 22.8878
90; 90; 90
2880.2Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C15H17N3O2S
Crystal Structure Report Archive, 2009, 629
1520423 CIFC11 H15 N3 OP 1 21/c 19.2292; 5.7759; 19.7467
90; 102.396; 90
1028.1Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C11H15N3O
Crystal Structure Report Archive, 2009, 630
1520424 CIFC7 H8 N2 O2P 21 21 213.8043; 12.987; 14.401
90; 90; 90
711.5Callear, Samantha K.; Hursthouse, Michael B.
2-methyl-3-nitroaniline
Crystal Structure Report Archive, 2009, 632
1520425 CIFC10 H15 N3 O2 SP 1 21/c 120.4469; 5.6971; 9.6808
90; 93.743; 90
1125.29Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C10H15N3O2S
Crystal Structure Report Archive, 2009, 645
1520426 CIFC20 H17 Fe N OP b c a17.4825; 7.342; 23.1152
90; 90; 90
2966.99Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C20H17FeNO
Crystal Structure Report Archive, 2009, 648
1520427 CIFC12 H8 N2 O4P -17.7644; 8.7396; 9.6184
108.028; 96.346; 107.648
576.19Holliman, Peter J.; Callear, Samantha K.; Hursthouse, Michael B.
C12H8N2O4
Crystal Structure Report Archive, 2009, 650
1520428 CIFC8 H14 I N O2 SiP 1 21 18.4342; 7.2543; 9.661
90; 103.079; 90
575.77Taylor, P. G.; Callear, Samantha K.; Hursthouse, Michael B.
C8H14INO2Si
Crystal Structure Report Archive, 2009, 652
1520429 CIFC15 H18 N2 O2P 1 21/n 18.0497; 17.7203; 10.1483
90; 102.323; 90
1414.23Huth, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-Butyryl-N-(2-cyanophenyl)butanamide
Crystal Structure Report Archive, 2009, 694
1520430 CIFC9 H11 N OP 1 21/n 111.1083; 4.8283; 15.2681
90; 99.17; 90
808.43Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(2-methylphenyl)acetamide
Crystal Structure Report Archive, 2009, 1367
1520431 CIFC8 H8 Br N OP 1 21/c 119.855; 5.002; 18.336
90; 108.655; 90
1725.4Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(3-bromophenyl)acetamide
Crystal Structure Report Archive, 2009, 1381
1520432 CIFC9 H11 N OP 1 21/c 112.2837; 9.4548; 7.3046
90; 99.932; 90
835.64Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(3-methylphenyl)acetamide
Crystal Structure Report Archive, 2009, 1382
1520433 CIFC10 H11 N O2P 21 21 217.5138; 9.3146; 12.8999
90; 90; 90
902.84Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-(4-acetylphenyl)acetamide
Crystal Structure Report Archive, 2009, 1399
1520434 CIFC22 H35 B N2 O4P -110.0998; 10.2807; 11.7549
100.067; 100.429; 103.216
1138.41Spencer, John; Callear, Samantha K.; Hursthouse, Michael B.
C22H35BN2O4
Crystal Structure Report Archive, 2009, 623
1520435 CIFC7.5 H9.5 N4.5 O0.5 ZnP b c a15.5741; 14.8047; 18.4602
90; 90; 90
4256.4Cheetham, A.K.; Bennett, T.D.; Callear, Samantha K.; Hursthouse, Michael B.
C7.5H9.5N4.5O0.5Zn
Crystal Structure Report Archive, 2009, 625
1520436 CIFC14 H15 N3 O2P 1 21 18.2919; 5.9109; 12.402
90; 96.272; 90
604.22Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C14H15N3O2
Crystal Structure Report Archive, 2009, 627
1520437 CIFC10 H20 N4 O6 S2P 1 21/c 113.2331; 11.7105; 10.2193
90; 99.664; 90
1561.17Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C10H20N4O6S2
Crystal Structure Report Archive, 2009, 628
1520438 CIFC14 H15 N3 O SP 1 21 16.278; 7.5736; 13.9057
90; 101.879; 90
647.02Spencer, John; Patel, Hiren; Callear, Samantha K.; Hursthouse, Michael B.
C14H15N3OS
Crystal Structure Report Archive, 2009, 631
1520457 CIFC13 H7 F4 NP 1 21/c 111.8955; 7.1235; 25.8183
90; 101.693; 90
2142.38Adler, Philip D. F.; Threlfall, Terence L.; Tizzard, Graham J.
C13H6F5N
Crystal Structure Report Archive, 2010, 1311
1520458 CIFC13 H6 F5 NC 1 2/c 126.11; 7.3243; 36.66
90; 110.593; 90
6562.8Adler, Philip D. F.; Threlfall, Terence L.; Tizzard, Graham J.; Coles, Simon J.
C13H6F5N
Crystal Structure Report Archive, 2010, 1313
1520459 CIFC15 H12 Br N O2C 1 2/c 119.623; 4.071; 32.979
90; 101.698; 90
2579.8Onyeabo, Romanus O.; Edwards, Mark; Spencer, John; Tizzard, Graham J.; Coles, Simon J.
Bromo Oxindole
Crystal Structure Report Archive, 2010, 1323
1520460 CIFC16 H13 N OP -18.1168; 9.2556; 9.3927
62.29; 80.933; 72.18
594.64Onyeabo, Romanus O.; Edwards, Mark; Spencer, John; Tizzard, Graham J.; Coles, Simon J.
Methyl oxindole
Crystal Structure Report Archive, 2010, 1324
1520461 CIFC15 H10 N2 O3P 1 21/c 19.9484; 7.9134; 16.013
90; 104.34; 90
1221.4Onyeabo, Romanus O.; Edwards, Mark; Spencer, John; Tizzard, Graham J.; Coles, Simon J.
Nitro oxindole
Crystal Structure Report Archive, 2010, 1325
1520462 CIFC15 H12 Cl N O2C 1 2/c 119.6553; 4.0406; 32.653
90; 101.378; 90
2542.3Onyeabo, Romanus O.; Edwards, Mark; Spencer, John; Tizzard, Graham J.; Coles, Simon J.
Chloro oxindole
Crystal Structure Report Archive, 2010, 1326
1520463 CIFC16 H13 N O2P -14.1302; 12.9513; 13.0829
62.708; 86.495; 86.546
620.35Onyeabo, Romanus O.; Edwards, Mark; Spencer, John; Tizzard, Graham J.; Coles, Simon J.
Methoxy oxindole
Crystal Structure Report Archive, 2010, 1327
1520464 CIFC17 H14 OC 1 2/c 113.3991; 8.2341; 22.8014
90; 96.356; 90
2500.2Cadman, Christopher J.; Coles, Simon J.; Croft, Anna K.; Frey, Jeremy G.; Tizzard, Graham J.
8-(p-tolyl)naphthalen-1-ol
Crystal Structure Report Archive, 2010, 1343
1520465 CIFC9 H8 F3 N O2C 1 c 14.4884; 22.168; 9.5284
90; 90.048; 90
948.1Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B.
N-[4-(trifluoromethoxy)phenyl]acetamide
Crystal Structure Report Archive, 2010, 1400
1520466 CIFC15 H12 Br N O2C 1 2/c 119.623; 4.071; 32.979
90; 101.698; 90
2579.8Onyeabo, Romanus O.; Edwards, Mark; Spencer, John; Tizzard, Graham J.; Coles, Simon J.
Bromo Oxindole
Crystal Structure Report Archive, 2010, 1505
1520467 CIFC27 H21 N OP -110.1895; 11.4764; 17.763
102.487; 96.931; 101.36
1959.2Tizzard, Graham J.; Coles, Simon J.; Hursthouse, Michael B.; Holliman, Peter J.
C27H21N1O1
Crystal Structure Report Archive, 2010, 1251
1520468 CIFC3 H12 B5 N O10P -18.0079; 8.8634; 8.8643
67.429; 88.975; 75.965
561.64Beckett, Michael A.; Timmis, James; Horton, Peter N.; Hursthouse, Michael B.
C3H12B5NO10
Crystal Structure Report Archive, 2010, 1258
1520469 CIFC5 H16 B5 N O10P 1 21/c 19.4446; 13.9129; 10.333
90; 92.517; 90
1356.46Beckett, Michael A.; Timmis, James; Horton, Peter N.; Hursthouse, Michael B.
C5H16B5NO10
Crystal Structure Report Archive, 2010, 1259
1520470 CIFC17 H15 Br Cl N2 O3 ReP 1 21/c 18.5959; 13.7519; 15.1599
90; 92.572; 90
1790.25Fletcher, Nicholas C.; Montgomery, Heather; Horton, Peter N.; Hursthouse, Michael B.
C17H15BrClN2O3Re
Crystal Structure Report Archive, 2010, 1260
1520471 CIFC40 H34 Cl2 P2 PdP -19.9242; 9.9428; 10.4323
86.305; 67.758; 62.176
834.69James, Stuart L.; Horton, Peter N.; Hursthouse, Michael B.
C40H34Cl2P2Pd
Crystal Structure Report Archive, 2010, 1262
1520472 CIFC40 H34 Cl2 P2 PtP -110.0905; 12.7583; 14.4492
100.026; 98.124; 108.201
1701.6James, Stuart L.; Horton, Peter N.; Hursthouse, Michael B.
C40H34Cl2P2Pt
Crystal Structure Report Archive, 2010, 1263
1520473 CIFC20.5 H20 Cl Fe N3 O2P 1 21/n 17.3738; 24.5405; 21.2954
90; 97.475; 90
3820.8Tizzard, Graham J.; Coles, Simon J.; Spencer, John
Ferrocene compound C41H40Cl2Fe2N6O4
Crystal Structure Report Archive, 2010, 1276
1520474 CIFC16 H16 Fe N2P b c a17.3279; 7.3648; 20.9885
90; 90; 90
2678.48Tizzard, Graham J.; Coles, Simon J.; Spencer, John
Ferrocene complex C16H16FeN2
Crystal Structure Report Archive, 2010, 1277
1520475 CIFC16 H44 F6 N2 O2 SiP 1 21/n 16.9836; 13.2116; 12.0495
90; 91.532; 90
1111.34Horton, Peter N.; Hursthouse, Michael B.; Taylor, Peter G.
[(C8H20N)2(SiF6).2H2O]
Crystal Structure Report Archive, 2010, 1346
1520476 CIFC13 H0 F3 NP 21 21 216.5932; 7.409; 21.4824
90; 90; 90
1049.39Threlfall, T.; Tizzard, G.; Ling, S.; Coles, S.
(E)-2,3,4-trifluoro-N-(4-fluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1428
1520477 CIFC13 H0 F5 NP -17.1359; 15.247; 20.576
87.348; 90; 90
2236.3Tizzard, G.; Ling, S.; Threlfall, T.; Coles, S.
(E)-3,5-difluoro-N-(3,4,5-trifluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1420
1520478 CIFC13 H0 F4 NP 1 21/n 16.5581; 22.185; 7.3736
90; 101.043; 90
1052.93Tizzard, G.; Ling, S.; Threlfall, T.; Coles, S.
(E)-4-fluoro-N-(2,3,4-trifluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1421
1520479 CIFC13 H0 F3 NP 1 21/n 112.8476; 3.7474; 21.5262
90; 97.291; 90
1028Tizzard, G.; Ling, S.; Threlfall, T.; Coles, S.
(E)-4-fluoro-N-(2,5-trifluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1422
1520480 CIFC13 H0 F3 NP 21 21 216.2066; 7.7799; 21.3938
90; 90; 90
1033.04Tizzard, G.; Threlfall, T.; Ling, S.; Coles, S.
(E)-3,5-difluoro-N-(4-fluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1423
1520481 CIFC13 H0 F3 NP 16.3923; 7.4769; 21.635
90; 90.03; 90
1034Tizzard, G.; Threlfall, T.; Ling, S.; Coles, S.
(E)-2,4-difluoro-N-(4-fluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1426
1520482 CIFC13 H0 F5 NC 1 c 13.6878; 48.796; 12.4014
90; 98.55; 90
2206.8Tizzard, G.; Threlfall, T.; Ling, S.; Coles, S.
(E)-2,4,6-trifluoro-N-(2,3-difluorobenzylidene)aniline
Crystal Structure Report Archive, 2010, 1427

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