Crystallography Open Database

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Searching journal of publication like 'Acta Crystallographica Section B' volume of publication is 53

COD ID: 1000058
CIF file Formula: - O2 Ru -
Comments: Bolzan A A; Fong C; Kennedy B J; Howard C J Structural studies of rutile-type metal dioxides Acta Crystallographica, Section B 53 (1997) 373-380
Space group: P 42/m n m
Cell volume: 62.8
Cell parameters: 4.4968; 4.4968; 3.1049; 90; 90; 90;  

COD ID: 1100099
CIF file Formula: - H2 Mg3 O10 S2 -
Comments: Fleet, M. E.; Knipe, S. W. Structure of magnesium hydroxide sulfate (2(Mg S O4) . (Mg (O H)2)) and solid solution in magnesium hydroxide sulfate hydrate and caminite Acta Crystallographica B (39,1983-) 53(3) (1997) 358-363
Space group: P 43 21 2
Cell volume: 715.9
Cell parameters: 7.454; 7.454; 12.885; 90; 90; 90;  

COD ID: 2101653
CIF file

Original IUCr paper

Formula: - C7 Br D16 N O2 -
Comments: Shankland, N.; Florence, A. J.; Wilson, C. C. Single-Crystal Neutron Diffraction Analysis of Anion–Cation Interactions in Perdeuteroacetylcholine Bromide at 100 K Acta Crystallographica Section B 53(1) (1997) 176-180
Space group: P 1 21/n 1
Cell volume: 981.6
Cell parameters: 10.951; 13.396; 7.072; 90; 108.88; 90;  

COD ID: 2101654
CIF file

Original IUCr paper

Formula: - O3 Pb Zr -
Comments: Corker, D. L.; Glazer, A. M.; Dec, J.; Roleder, K.; Whatmore, R. W. A Re-investigation of the Crystal Structure of the Perovskite PbZrO~3~ by X-ray and Neutron Diffraction Acta Crystallographica Section B 53(1) (1997) 135-142
Space group: P b a m
Cell volume: 570.9
Cell parameters: 5.884; 11.787; 8.231; 90; 90; 90;  

COD ID: 2101655
CIF file

Original IUCr paper

Formula: - O3 Pb Zr -
Comments: Corker, D. L.; Glazer, A. M.; Dec, J.; Roleder, K.; Whatmore, R. W. A Re-investigation of the Crystal Structure of the Perovskite PbZrO~3~ by X-ray and Neutron Diffraction Acta Crystallographica Section B 53(1) (1997) 135-142
Space group: P b a m
Cell volume: 572.83
Cell parameters: 5.8878; 11.789; 8.2527; 90; 90; 90;  

COD ID: 2101656
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 446.29
Cell parameters: 5.99986; 5.99986; 12.3976; 90; 90; 90;  

COD ID: 2101657
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 446.5
Cell parameters: 6.00092; 6.00092; 12.3989; 90; 90; 90;  

COD ID: 2101658
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 446.78
Cell parameters: 6.00193; 6.00193; 12.4027; 90; 90; 90;  

COD ID: 2101659
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 447.29
Cell parameters: 6.00313; 6.00313; 12.4118; 90; 90; 90;  

COD ID: 2101660
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 447.78
Cell parameters: 6.00301; 6.00301; 12.4258; 90; 90; 90;  

COD ID: 2101661
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 448.21
Cell parameters: 6.00091; 6.00091; 12.4466; 90; 90; 90;  

COD ID: 2101662
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 448.56
Cell parameters: 5.9956; 5.9956; 12.4783; 90; 90; 90;  

COD ID: 2101663
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 447.09
Cell parameters: 5.98872; 5.98872; 12.466; 90; 90; 90;  

COD ID: 2101664
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 447.225
Cell parameters: 5.97765; 5.97765; 12.516; 90; 90; 90;  

COD ID: 2101665
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 447.12
Cell parameters: 5.95898; 5.95898; 12.5916; 90; 90; 90;  

COD ID: 2101666
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 446.59
Cell parameters: 5.9324; 5.9324; 12.6897; 90; 90; 90;  

COD ID: 2101667
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 446.45
Cell parameters: 5.91124; 5.91124; 12.7765; 90; 90; 90;  

COD ID: 2101668
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 446.77
Cell parameters: 5.89725; 5.89725; 12.8464; 90; 90; 90;  

COD ID: 2101669
CIF file

Original IUCr paper

Formula: - D4 N O4 Re -
Comments: I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B 53(1) (1997) 76-81
Space group: I 41/a :2
Cell volume: 449.11
Cell parameters: 5.8805; 5.8805; 12.9874; 90; 90; 90;  

COD ID: 2101670
CIF file

Original IUCr paper

Formula: - C12 H28 F12 N2 P2 -
Comments: McCormack, Kirsty L.; Mallinson, Paul R.; Webster, Brian C.; Yufit, Dmitrii S. Experimental and Theoretical Studies of Charge Density Distribution in <i>E</i>-Tetraethyl-1,4-diammoniumbut-2-ene.2PF~6~ Acta Crystallographica Section B 53(1) (1997) 181-187
Space group: P 1 21/c 1
Cell volume: 1080.7
Cell parameters: 6.282; 13.252; 13.112; 90; 98.08; 90;  

COD ID: 2101671
CIF file

Original IUCr paper

Formula: - Al2 O5 Si -
Comments: Pilati, T.; Demartin, F.; Gramaccioli, C. M. Transferability of Empirical Force Fields in Silicates: Lattice-Dynamical Evaluation of Atomic Displacement Parameters and Thermodynamic Properties for the Al~2~OSiO~4~ Polymorphs Acta Crystallographica Section B 53(1) (1997) 82-94
Space group: P n n m
Cell volume: 342.73
Cell parameters: 7.7992; 7.905; 5.5591; 90; 90; 90;  

COD ID: 2101672
CIF file

Original IUCr paper

Formula: - Ag2 P2 S11 Ti2 -
Comments: Gaudin, E.; Fischer, L.; Boucher, F.; Evain, M.; Petricek, V. Ag~2~Ti~2~P~2~S~11~: A New Layered Thiophosphate. Synthesis, Structure Determination and Temperature Dependence of the Silver Distribution Acta Crystallographica Section B 53(1) (1997) 67-75
Space group: P n m a
Cell volume: 1406.4
Cell parameters: 8.5222; 6.8359; 24.142; 90; 90; 90;  

COD ID: 2101673
CIF file

Original IUCr paper

Formula: - H4 Na3 Nd O17 Si6 -
Comments: Haile, S. M.; Wuensch, B. J.; Laudise, R. A.; Maier, J. Structure of Na~3~NdSi~6~O~15~.2H~2~O ‒ a Layered Silicate with Paths for Possible Fast-Ion Conduction Acta Crystallographica Section B 53(1) (1997) 7-17
Space group: C m m 2
Cell volume: 1620.4
Cell parameters: 7.385; 30.831; 7.1168; 90; 90; 90;  

COD ID: 2101674
CIF file

Original IUCr paper

Formula: - O4 W Zn -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P 1 2/c 1
Cell volume: 132.3
Cell parameters: 4.69263; 5.72129; 4.92805; 90; 90.6321; 90;  

COD ID: 2101675
CIF file

Original IUCr paper

Formula: - Cu0.1 O4 W Zn0.9 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P 1 2/c 1
Cell volume: 132.293
Cell parameters: 4.69114; 5.72608; 4.92536; 90; 90.7507; 90;  

COD ID: 2101676
CIF file

Original IUCr paper

Formula: - Cu0.15 O4 W Zn0.85 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P 1 2/c 1
Cell volume: 132.095
Cell parameters: 4.68766; 5.72752; 4.92052; 90; 90.8566; 90;  

COD ID: 2101677
CIF file

Original IUCr paper

Formula: - Cu0.2 O4 W Zn0.8 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P 1 2/c 1
Cell volume: 131.985
Cell parameters: 4.68502; 5.73194; 4.9156; 90; 91.0026; 90;  

COD ID: 2101678
CIF file

Original IUCr paper

Formula: - Cu0.25 O4 W Zn0.75 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 131.966
Cell parameters: 4.68499; 5.73796; 4.91163; 89.766; 91.135; 91.467;  

COD ID: 2101679
CIF file

Original IUCr paper

Formula: - Cu0.3 O4 W Zn0.7 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 131.963
Cell parameters: 4.68411; 5.74374; 4.90925; 89.6303; 91.1899; 92.073;  

COD ID: 2101680
CIF file

Original IUCr paper

Formula: - Cu0.35 O4 W Zn0.65 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.403
Cell parameters: 4.6901; 5.76474; 4.90647; 89.3597; 91.3394; 93.2364;  

COD ID: 2101681
CIF file

Original IUCr paper

Formula: - Cu0.4 O4 W Zn0.6 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.425
Cell parameters: 4.69097; 5.7751; 4.90169; 89.2071; 91.487; 93.9239;  

COD ID: 2101682
CIF file

Original IUCr paper

Formula: - Cu0.45 O4 W Zn0.55 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.464
Cell parameters: 4.69174; 5.77857; 4.90054; 89.1685; 91.519; 94.1;  

COD ID: 2101683
CIF file

Original IUCr paper

Formula: - Cu0.55 O4 W Zn0.45 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.736
Cell parameters: 4.69651; 5.80159; 4.89491; 88.913; 91.8172; 95.215;  

COD ID: 2101684
CIF file

Original IUCr paper

Formula: - Cu0.6 O4 W Zn0.4 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.588
Cell parameters: 4.6947; 5.8028; 4.89158; 88.871; 91.828; 95.367;  

COD ID: 2101685
CIF file

Original IUCr paper

Formula: - Cu0.65 O4 W Zn0.35 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.962
Cell parameters: 4.70189; 5.81866; 4.89057; 88.706; 92.051; 95.982;  

COD ID: 2101686
CIF file

Original IUCr paper

Formula: - Cu0.7 O4 W Zn0.3 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.918
Cell parameters: 4.7013; 5.8207; 4.889; 88.678; 92.073; 96.099;  

COD ID: 2101687
CIF file

Original IUCr paper

Formula: - Cu0.7 O4 W Zn0.25 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 132.951
Cell parameters: 4.70508; 5.82979; 4.88441; 88.5414; 92.2845; 96.6112;  

COD ID: 2101688
CIF file

Original IUCr paper

Formula: - Cu0.8 O4 W Zn0.2 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 133.124
Cell parameters: 4.70707; 5.83407; 4.88649; 88.511; 92.3254; 96.735;  

COD ID: 2101689
CIF file

Original IUCr paper

Formula: - Cu0.85 O4 W Zn0.15 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 133.008
Cell parameters: 4.70559; 5.83597; 4.88391; 88.4601; 92.3623; 96.8837;  

COD ID: 2101690
CIF file

Original IUCr paper

Formula: - Cu0.9 O4 W Zn0.1 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 133.123
Cell parameters: 4.7095; 5.8403; 4.88323; 88.413; 92.5035; 97.095;  

COD ID: 2101691
CIF file

Original IUCr paper

Formula: - Cu0.95 O4 W Zn0.05 -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 133.004
Cell parameters: 4.70682; 5.83985; 4.88214; 88.3889; 92.4646; 97.1148;  

COD ID: 2101692
CIF file

Original IUCr paper

Formula: - Cu O4 W -
Comments: Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B 53(1) (1997) 102-112
Space group: P -1
Cell volume: 133.246
Cell parameters: 4.70953; 5.84516; 4.88492; 88.353; 92.5081; 97.2047;  

COD ID: 2101693
CIF file

Original IUCr paper

Formula: - B6 Ce -
Comments: Tanaka, K.; Kato, Y.; Onuki, Y. 4<i>f</i>-Electron Density Distribution in Crystals of CeB~6~ at 165 K and its Analysis Based on the Crystal Field Theory Acta Crystallographica Section B 53(1) (1997) 143-152
Space group: P m -3 m
Cell volume: 70.8623
Cell parameters: 4.13814; 4.13814; 4.13814; 90; 90; 90;  

COD ID: 2101694
CIF file

Original IUCr paper

Formula: - C22 H16 Cu N2 S18 -
Comments: Rahal, M.; Chasseau, D.; Gaultier, J.; Ducasse, L.; Kurmoo, M.; Day, P. Isothermal Compressibility and Pressure Dependence of the Crystal Structures of the Superconducting Charge-Transfer Salt κ-(BEDT-TTF)~2~Cu(NCS)~2~ [BEDT-TTF = Bis(ethylenedithio)tetrathiafulvalene] Acta Crystallographica Section B 53(1) (1997) 159-167
Space group: P 1 21 1
Cell volume: 1685.3
Cell parameters: 16.228; 8.442; 13.113; 90; 110.26; 90;  

COD ID: 2101695
CIF file

Original IUCr paper

Formula: - C22 H16 Cu N2 S18 -
Comments: Rahal, M.; Chasseau, D.; Gaultier, J.; Ducasse, L.; Kurmoo, M.; Day, P. Isothermal Compressibility and Pressure Dependence of the Crystal Structures of the Superconducting Charge-Transfer Salt κ-(BEDT-TTF)~2~Cu(NCS)~2~ [BEDT-TTF = Bis(ethylenedithio)tetrathiafulvalene] Acta Crystallographica Section B 53(1) (1997) 159-167
Space group: P 1 21 1
Cell volume: 1601.3
Cell parameters: 16.138; 8.3; 12.829; 90; 111.27; 90;  

COD ID: 2101696
CIF file

Original IUCr paper

Formula: - C4 H8 O35 Si17 -
Comments: Knorr, K.; Depmeier, W. Room-Temperatrue Structure and Geometrical Analysis of the Cubic‒Tetragonal Phase Transition in Dodecasil 3C-THF Acta Crystallographica Section B 53(1) (1997) 18-24
Space group: I 41/a :2
Cell volume: 3648
Cell parameters: 13.684; 13.684; 19.482; 90; 90; 90;  

COD ID: 2101697
CIF file

Original IUCr paper

Formula: - F6 Na Sb -
Comments: Sowa, H. Pressure-Induced <i>Fm</i>-3<i>m</i> <i>R</i>-3 Phase Transition in NaSbF~6~ Acta Crystallographica Section B 53(1) (1997) 25-31
Space group: F m -3 m
Cell volume: 551
Cell parameters: 8.198; 8.198; 8.198; 90; 90; 90;  

COD ID: 2101698
CIF file

Original IUCr paper

Formula: - Mg Na2 O4 Si -
Comments: Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B 53(2) (1997) 203-220
Space group: P n a 21
Cell volume: 404.2
Cell parameters: 10.835; 5.279; 7.067; 90; 90; 90;  

COD ID: 2101699
CIF file

Original IUCr paper

Formula: - Mg Na2 O4 Si -
Comments: Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B 53(2) (1997) 203-220
Space group: P n a 21
Cell volume: 404.2
Cell parameters: 10.835; 5.279; 7.067; 90; 90; 90;  

COD ID: 2101700
CIF file

Original IUCr paper

Formula: - Mg Na2 O4 Si -
Comments: Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B 53(2) (1997) 203-220
Space group: P n a 21
Cell volume: 404.2
Cell parameters: 10.835; 5.279; 7.067; 90; 90; 90;  

COD ID: 2101701
CIF file

Original IUCr paper

Formula: - Mg Na2 O4 Si -
Comments: Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterisation of Three New Cristobalite-related Sodium Magnesiosilicates Acta Crystallographica, Section B 53(2) (1997) 203-220
Space group: P n a 21
Cell volume: 404.2
Cell parameters: 10.835; 5.279; 7.067; 90; 90; 90;  

COD ID: 2101702
CIF file

Original IUCr paper

Formula: - Al0.15 Mg0.79 Na1.74 O4 Si1.06 -
Comments: Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterization of Three New Cristobalite-Related Sodium Magnesiosilicates Acta Crystallographica Section B 53(2) (1997) 203-220
Space group: P b c a
Cell volume: 789.1
Cell parameters: 10.487; 14.351; 5.243; 90; 90; 90;  

COD ID: 2101703
CIF file

Original IUCr paper

Formula: - Mg0.9 Na1.8 O4 Si1.1 -
Comments: Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterization of Three New Cristobalite-Related Sodium Magnesiosilicates Acta Crystallographica Section B 53(2) (1997) 203-220
Space group: P 41 21 2
Cell volume: 201.3
Cell parameters: 5.33; 5.33; 7.086; 90; 90; 90;  

COD ID: 2101704
CIF file

Original IUCr paper

Formula: - O4 Sb0.92 V1.08 -
Comments: Landa-Cánovas, A. R.; Hansen, S.; Ståhl, K. Rutile Superstructure of Sb~0.9~V~1.1~O~4~ Acta Crystallographica Section B 53(2) (1997) 221-230
Space group: P 42/m n m
Cell volume: 65.556
Cell parameters: 4.6085; 4.6085; 3.0867; 90; 90; 90;  

COD ID: 2101705
CIF file

Original IUCr paper

Formula: - O4 Sb0.9 V1.1 -
Comments: Landa-Cánovas, A. R.; Hansen, S.; Ståhl, K. Rutile Superstructure of Sb~0.9~V~1.1~O~4~ Acta Crystallographica Section B 53(2) (1997) 221-230
Space group: I 41 m d
Cell volume: 262.224
Cell parameters: 6.5174; 6.5174; 6.1734; 90; 90; 90;  

COD ID: 2101706
CIF file

Original IUCr paper

Formula: - C8 H7 F O3 -
Comments: Larsen, S.; Marthi, K. Structures of the Optically Active Monofluoro-Substituted Mandelic Acids: Relation to Their Racemic Counterparts and Thermochemical Properties Acta Crystallographica Section B 53(2) (1997) 280-292
Space group: P 1 21 1
Cell volume: 772
Cell parameters: 8.356; 10.842; 8.544; 90; 94.13; 90;  

COD ID: 2101707
CIF file

Original IUCr paper

Formula: - C8 H7 F O3 -
Comments: Larsen, S.; Marthi, K. Structures of the Optically Active Monofluoro-Substituted Mandelic Acids: Relation to Their Racemic Counterparts and Thermochemical Properties Acta Crystallographica Section B 53(2) (1997) 280-292
Space group: P 1 21 1
Cell volume: 752.1
Cell parameters: 8.493; 5.8426; 15.628; 90; 104.1; 90;  

COD ID: 2101708
CIF file

Original IUCr paper

Formula: - C8 H7 F O3 -
Comments: Larsen, S.; Marthi, K. Structures of the Optically Active Monofluoro-Substituted Mandelic Acids: Relation to Their Racemic Counterparts and Thermochemical Properties Acta Crystallographica Section B 53(2) (1997) 280-292
Space group: C 1 2 1
Cell volume: 749.3
Cell parameters: 8.464; 5.8518; 15.868; 90; 107.56; 90;  

COD ID: 2101709
CIF file

Original IUCr paper

Formula: - C6 H12 Cl2 N2 O2 Sn -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1229.2
Cell parameters: 9.1314; 12.8672; 13.0317; 90; 126.603; 90;  

COD ID: 2101710
CIF file

Original IUCr paper

Formula: - C3 H4 F K O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2972
Cell parameters: 19.463; 18.92; 8.735; 90; 112.5; 90;  

COD ID: 2101711
CIF file

Original IUCr paper

Formula: - C42 H68 Co2 N10 O6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4915
Cell parameters: 19.369; 9.06; 28.76; 90; 103.13; 90;  

COD ID: 2101712
CIF file

Original IUCr paper

Formula: - C20 H24 Br4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2037
Cell parameters: 9.147; 20.925; 11.276; 90; 109.33; 90;  

COD ID: 2101713
CIF file

Original IUCr paper

Formula: - C16 H15 Cl3 N2 O5 S -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 7894.4
Cell parameters: 10.632; 73.538; 10.097; 90; 90; 90;  

COD ID: 2101714
CIF file

Original IUCr paper

Formula: - C36 H46 F12 N6 Ni O2 P2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 8931.86
Cell parameters: 20.074; 42.388; 10.497; 90; 90; 90;  

COD ID: 2101715
CIF file

Original IUCr paper

Formula: - C40 H30 F6 N O5 P2 Rh -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3927.6
Cell parameters: 12.593; 15.466; 20.479; 90; 100.03; 90;  

COD ID: 2101716
CIF file

Original IUCr paper

Formula: - C14 H25 Cl2 N2 O10 Rh -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2056.6
Cell parameters: 13.591; 10.704; 14.416; 90; 101.29; 90;  

COD ID: 2101717
CIF file

Original IUCr paper

Formula: - C11 H14 O6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 4687.69
Cell parameters: 11.364; 32.149; 12.831; 90; 90; 90;  

COD ID: 2101718
CIF file

Original IUCr paper

Formula: - C36 H30 Cl2 Co O2 P2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 6671.22
Cell parameters: 20.712; 32.934; 9.78; 90; 90; 90;  

COD ID: 2101719
CIF file

Original IUCr paper

Formula: - C16 H21 Cl3 Cu N O P -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3912
Cell parameters: 12.7; 12.6; 24.45; 90; 91; 90;  

COD ID: 2101720
CIF file

Original IUCr paper

Formula: - C24 H33 Cl3 Ir P3 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 7936.3
Cell parameters: 14.924; 14.924; 41.145; 90; 90; 120;  

COD ID: 2101721
CIF file

Original IUCr paper

Formula: - C19 H21 Cu N3 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2018
Cell parameters: 17.22; 5.92; 22.14; 90; 116.6; 90;  

COD ID: 2101722
CIF file

Original IUCr paper

Formula: - C34 H20 Cr2 O11 P2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3451.1
Cell parameters: 10.217; 19.954; 17.1; 90; 98.14; 90;  

COD ID: 2101723
CIF file

Original IUCr paper

Formula: - C32 H72 Si4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3792
Cell parameters: 10.017; 19.639; 20.129; 90; 106.744; 90;  

COD ID: 2101724
CIF file

Original IUCr paper

Formula: - C10 H29 Cl5 N2 Sn -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2110.1
Cell parameters: 14.088; 11.237; 13.331; 90; 90.97; 90;  

COD ID: 2101725
CIF file

Original IUCr paper

Formula: - C12 H33 Br5 N2 Sn -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2359.5
Cell parameters: 14.277; 11.669; 14.163; 90; 90.3; 90;  

COD ID: 2101726
CIF file

Original IUCr paper

Formula: - C17 H18 N4 O2 P2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 3423.12
Cell parameters: 20.95; 29.162; 5.603; 90; 90; 90;  

COD ID: 2101727
CIF file

Original IUCr paper

Formula: - C28 H68 Fe Mo2 N3 S10 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4498
Cell parameters: 14.003; 18.397; 17.571; 90; 96.46; 90;  

COD ID: 2101728
CIF file

Original IUCr paper

Formula: - C12 H9 O3 P Se -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 1878.43
Cell parameters: 12.522; 12.522; 13.833; 90; 90; 120;  

COD ID: 2101729
CIF file

Original IUCr paper

Formula: - C20 H36 Cl2 N4 Pd2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3282
Cell parameters: 12.665; 14.449; 18.402; 90; 102.94; 90;  

COD ID: 2101730
CIF file

Original IUCr paper

Formula: - C4 H8 Cl2 Ge O2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 782.5
Cell parameters: 7.59; 11.72; 8.85; 90; 96.3; 90;  

COD ID: 2101731
CIF file

Original IUCr paper

Formula: - C32 H46 Cr4 Mn S6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3712
Cell parameters: 26.54; 9.208; 21.595; 90; 135.3; 90;  

COD ID: 2101732
CIF file

Original IUCr paper

Formula: - C32 H46 Cr4 Fe S6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3659.6
Cell parameters: 26.738; 9.195; 21.419; 90; 135.976; 90;  

COD ID: 2101733
CIF file

Original IUCr paper

Formula: - C20 H38 N4 O7 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2349.7
Cell parameters: 21.04; 9.172; 14.873; 90; 125.05; 90;  

COD ID: 2101734
CIF file

Original IUCr paper

Formula: - C40 H88 Si4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4937.65
Cell parameters: 20.495; 21.172; 11.554; 90; 99.98; 90;  

COD ID: 2101735
CIF file

Original IUCr paper

Formula: - C15 H11 Cl4 O2 Sb -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1734.8
Cell parameters: 18.706; 9.961; 12.404; 90; 131.36; 90;  

COD ID: 2101736
CIF file

Original IUCr paper

Formula: - C40 H74 O8 P4 Rh6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 5968
Cell parameters: 24.002; 11.957; 22.399; 90; 111.805; 90;  

COD ID: 2101737
CIF file

Original IUCr paper

Formula: - C63 H45 Br3 Ni2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 8303.49
Cell parameters: 15.348; 15.348; 40.703; 90; 90; 120;  

COD ID: 2101738
CIF file

Original IUCr paper

Formula: - C36 H36 Cu N6 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3764.1
Cell parameters: 23.088; 6.987; 23.641; 90; 99.25; 90;  

COD ID: 2101739
CIF file

Original IUCr paper

Formula: - C16 H16 O2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 2571.41
Cell parameters: 12.423; 22.107; 9.363; 90; 90; 90;  

COD ID: 2101740
CIF file

Original IUCr paper

Formula: - C19 H47 Cu6 Mo6 N3 O7 S19 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 5350
Cell parameters: 21.32; 21.869; 13.029; 90; 118.28; 90;  

COD ID: 2101741
CIF file

Original IUCr paper

Formula: - C20 H32 O5 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3825.6
Cell parameters: 15.994; 11.238; 21.793; 90; 102.41; 90;  

COD ID: 2101742
CIF file

Original IUCr paper

Formula: - C39 H46 O14 V2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4038.3
Cell parameters: 14.207; 24.289; 11.773; 90; 96.27; 90;  

COD ID: 2101743
CIF file

Original IUCr paper

Formula: - C12 H12 B Cs O14 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1755.2
Cell parameters: 17.399; 11.655; 8.701; 90; 95.86; 90;  

COD ID: 2101744
CIF file

Original IUCr paper

Formula: - C15 H23 N O2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1571.59
Cell parameters: 11.969; 14.057; 10.851; 90; 120.59; 90;  

COD ID: 2101745
CIF file

Original IUCr paper

Formula: - C18 H24 Co N6 O9 S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2469
Cell parameters: 18.8487; 11.1363; 12.406; 90; 108.535; 90;  

COD ID: 2101746
CIF file

Original IUCr paper

Formula: - C54 H38 O6 P2 Pt -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 9776
Cell parameters: 22.08; 14.47; 30.72; 90; 95.1; 90;  

COD ID: 2101747
CIF file

Original IUCr paper

Formula: - C20 H38 Co N2 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2377.6
Cell parameters: 10.127; 19.197; 12.23; 90; 90.39; 90;  

COD ID: 2101748
CIF file

Original IUCr paper

Formula: - C20 H12 Ag N9 O3 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1945.8
Cell parameters: 16.484; 7.725; 17.1; 90; 116.67; 90;  

COD ID: 2101749
CIF file

Original IUCr paper

Formula: - C40 H36 Cl N2 O P2 Rh -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3521.5
Cell parameters: 12.192; 14.125; 20.474; 90; 92.85; 90;  

COD ID: 2101750
CIF file

Original IUCr paper

Formula: - C9 H16 O5 Si2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1194.8
Cell parameters: 10.144; 7.866; 15.503; 90; 105.02; 90;  

COD ID: 2101751
CIF file

Original IUCr paper

Formula: - C14 H20 Cu2 N10 O11 S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2451.2
Cell parameters: 16.445; 13.889; 12.77; 90; 122.82; 90;  

COD ID: 2101752
CIF file

Original IUCr paper

Formula: - C9 H29 I O2 Sn3 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: I -4 c 2
Cell volume: 4167.76
Cell parameters: 15.524; 15.524; 17.294; 90; 90; 90;  

COD ID: 2101753
CIF file

Original IUCr paper

Formula: - C10 H23 N3 O11.5 V -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 6717.8
Cell parameters: 15.508; 59.948; 7.226; 90; 90; 90;  

COD ID: 2101754
CIF file

Original IUCr paper

Formula: - C5 H6 N2 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 676.95
Cell parameters: 11.421; 6.019; 10.177; 90; 104.62; 90;  

COD ID: 2101755
CIF file

Original IUCr paper

Formula: - C32 H39 N3 O4 Sr -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3072
Cell parameters: 15.91; 13.04; 16.522; 90; 116.33; 90;  

COD ID: 2101756
CIF file

Original IUCr paper

Formula: - C7 H10 Cu F6 N S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1262.2
Cell parameters: 14.911; 10.589; 8.765; 90; 114.21; 90;  

COD ID: 2101757
CIF file

Original IUCr paper

Formula: - C32 H48 I2 Na2 O14 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 8030.83
Cell parameters: 16.153; 43.501; 11.429; 90; 90; 90;  

COD ID: 2101758
CIF file

Original IUCr paper

Formula: - C24 H67 N25 Si4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 5950.26
Cell parameters: 22.643; 22.643; 13.401; 90; 90; 120;  

COD ID: 2101759
CIF file

Original IUCr paper

Formula: - C44 H37 Cl O P2 Ru -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3632.8
Cell parameters: 12.967; 13.801; 20.368; 90; 94.7; 90;  

COD ID: 2101760
CIF file

Original IUCr paper

Formula: - C44 H80 Si5 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 9935
Cell parameters: 32.228; 16.373; 20.689; 90; 114.49; 90;  

COD ID: 2101761
CIF file

Original IUCr paper

Formula: - C12 H38 N6 O16 S2 W2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2654
Cell parameters: 17.601; 12.906; 14.107; 90; 124.08; 90;  

COD ID: 2101762
CIF file

Original IUCr paper

Formula: - C24 H20 O12 Rh6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3049.9
Cell parameters: 17.635; 9.561; 18.234; 90; 97.24; 90;  

COD ID: 2101763
CIF file

Original IUCr paper

Formula: - C25 H26 N9 S3 Y -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 5609.7
Cell parameters: 33.226; 11.986; 14.102; 90; 92.72; 90;  

COD ID: 2101764
CIF file

Original IUCr paper

Formula: - C25 H26 Eu N9 S3 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 5632.8
Cell parameters: 33.244; 11.976; 14.164; 90; 92.72; 90;  

COD ID: 2101765
CIF file

Original IUCr paper

Formula: - C15 H14 N2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 2370
Cell parameters: 9.503; 16.429; 15.18; 90; 90; 90;  

COD ID: 2101766
CIF file

Original IUCr paper

Formula: - C37 H31 Ag O2 P2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3132.6
Cell parameters: 24.952; 9.179; 15.262; 90; 116.34; 90;  

COD ID: 2101767
CIF file

Original IUCr paper

Formula: - C36 H28 F12 Pt S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3420
Cell parameters: 17.333; 16.072; 12.354; 90; 96.48; 90;  

COD ID: 2101768
CIF file

Original IUCr paper

Formula: - C26 H38 As Cl Si2 Ti2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 5501
Cell parameters: 30.71; 18.495; 9.685; 90; 90; 90;  

COD ID: 2101769
CIF file

Original IUCr paper

Formula: - C14 H18 Cl2 N4 Ni O12 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2130.44
Cell parameters: 24.4019; 11.9871; 7.4982; 90; 103.749; 90;  

COD ID: 2101770
CIF file

Original IUCr paper

Formula: - C20 H32 N2 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2028.6
Cell parameters: 19.169; 9.079; 14.636; 90; 127.21; 90;  

COD ID: 2101771
CIF file

Original IUCr paper

Formula: - C22 H16 Cl Hg N2 S18 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3574
Cell parameters: 36.69; 8.302; 11.732; 90; 90.02; 90;  

COD ID: 2101772
CIF file

Original IUCr paper

Formula: - C16 H28 Ni O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1953.6
Cell parameters: 15.524; 8.52; 15.588; 90; 108.64; 90;  

COD ID: 2101773
CIF file

Original IUCr paper

Formula: - C28 H35 O P Ru Si2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 5442.2
Cell parameters: 24.758; 15.25; 18.811; 90; 129.98; 90;  

COD ID: 2101774
CIF file

Original IUCr paper

Formula: - C18 H39 O2 P -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2056
Cell parameters: 52.7; 4.81; 8.86; 90; 113.7; 90;  

COD ID: 2101775
CIF file

Original IUCr paper

Formula: - C32 H25 Cl6 Cu N5 O7 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3557
Cell parameters: 24.301; 8.075; 18.131; 90; 91.44; 90;  

COD ID: 2101776
CIF file

Original IUCr paper

Formula: - C25 H28 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4286
Cell parameters: 26.24; 6.109; 26.756; 90; 87.9; 90;  

COD ID: 2101777
CIF file

Original IUCr paper

Formula: - C4 F12 O5 Sb2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1358.1
Cell parameters: 12.332; 13.867; 9.443; 90; 122.75; 90;  

COD ID: 2101778
CIF file

Original IUCr paper

Formula: - C12 H10 I2 N2 O7 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1627
Cell parameters: 16.143; 7.067; 15.058; 90; 108.72; 90;  

COD ID: 2101779
CIF file

Original IUCr paper

Formula: - C52 H44 B F5 Mo O P4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4755
Cell parameters: 17.481; 15.05; 18.15; 90; 95.23; 90;  

COD ID: 2101780
CIF file

Original IUCr paper

Formula: - C26 H30 O2 Yb -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2328.7
Cell parameters: 13.506; 11.081; 15.577; 90; 92.68; 90;  

COD ID: 2101781
CIF file

Original IUCr paper

Formula: - C15 H45 N3 Si4 Ti -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 3945.84
Cell parameters: 15.305; 15.305; 19.451; 90; 90; 120;  

COD ID: 2101782
CIF file

Original IUCr paper

Formula: - C15 H45 Ge N3 Si3 Ti -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 3983.67
Cell parameters: 15.351; 15.351; 19.52; 90; 90; 120;  

COD ID: 2101783
CIF file

Original IUCr paper

Formula: - C12 H12 Cl2 N2 Pt -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1268
Cell parameters: 13.413; 9.063; 12.261; 90; 121.71; 90;  

COD ID: 2101784
CIF file

Original IUCr paper

Formula: - C24 H36 Ir2 S -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 9388
Cell parameters: 14.132; 75.251; 8.828; 90; 90; 90;  

COD ID: 2101785
CIF file

Original IUCr paper

Formula: - C14 H18 Cl Cu N2 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1639.1
Cell parameters: 14.501; 8.236; 14.858; 90; 112.53; 90;  

COD ID: 2101786
CIF file

Original IUCr paper

Formula: - C2 F6 Na2 O4 Sb2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 883.6
Cell parameters: 17.213; 6.342; 8.168; 90; 97.7; 90;  

COD ID: 2101787
CIF file

Original IUCr paper

Formula: - C28 H26 Cl4 O4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2619.7
Cell parameters: 27.429; 7.664; 13.183; 90; 109.04; 90;  

COD ID: 2101788
CIF file

Original IUCr paper

Formula: - C37 H31 Cl2 F2 P2 Rh -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3362
Cell parameters: 18.391; 9.753; 21.664; 90; 120.094; 90;  

COD ID: 2101789
CIF file

Original IUCr paper

Formula: - C20 H16 Br N O -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3217.8
Cell parameters: 26.354; 5.163; 23.654; 90; 91.2; 90;  

COD ID: 2101790
CIF file

Original IUCr paper

Formula: - C13 H34 B2 Co F8 N P4 S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 2692.7
Cell parameters: 15.927; 11.726; 14.422; 90; 91.38; 90;  

COD ID: 2101791
CIF file

Original IUCr paper

Formula: - C27 H22 N2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 4001.8
Cell parameters: 56.474; 11.457; 6.185; 90; 90; 90;  

COD ID: 2101792
CIF file

Original IUCr paper

Formula: - C4 H16 Co N7 O6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1132.4
Cell parameters: 9.198; 12.444; 9.963; 90; 96.76; 90;  

COD ID: 2101793
CIF file

Original IUCr paper

Formula: - C37 H40 O2 Ti2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3069.6
Cell parameters: 25.448; 8.483; 14.512; 90; 101.53; 90;  

COD ID: 2101794
CIF file

Original IUCr paper

Formula: - C26 H38 O12 Rh6 S4 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3790
Cell parameters: 20.444; 9.764; 19.589; 90; 104.27; 90;  

COD ID: 2101795
CIF file

Original IUCr paper

Formula: - C73 H108 O12 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 6899
Cell parameters: 25.442; 10.051; 27.062; 90; 94.5; 90;  

COD ID: 2101796
CIF file

Original IUCr paper

Formula: - C13 H10 Br2 N2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1268.3
Cell parameters: 12.972; 10.537; 9.567; 90; 104.09; 90;  

COD ID: 2101797
CIF file

Original IUCr paper

Formula: - C34.12 H41.48 Cl2 Co N5 O3.12 S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3732.8
Cell parameters: 18.715; 18.401; 12.794; 90; 122.09; 90;  

COD ID: 2101798
CIF file

Original IUCr paper

Formula: - C16 H23 Ni P S4 W -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 8872
Cell parameters: 17.47; 25.519; 19.9; 90; 90; 90;  

COD ID: 2101799
CIF file

Original IUCr paper

Formula: - C46 H42 Cl6 N2 O6 P2 Rh2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4913.8
Cell parameters: 20.808; 12.368; 20.514; 90; 111.446; 90;  

COD ID: 2101800
CIF file

Original IUCr paper

Formula: - C21 H50 Al4 Cl4 O8 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3619.6
Cell parameters: 15.805; 12.727; 18.157; 90; 97.67; 90;  

COD ID: 2101801
CIF file

Original IUCr paper

Formula: - C6 H9 As O6 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: R 3 c :H
Cell volume: 1455.15
Cell parameters: 13.203; 13.203; 9.639; 90; 90; 120;  

COD ID: 2101802
CIF file

Original IUCr paper

Formula: - C17 H15 Fe N -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 5397
Cell parameters: 37.329; 24.606; 5.876; 90; 90; 90;  

COD ID: 2101803
CIF file

Original IUCr paper

Formula: - C6 H4 N2 O2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: F d d 2
Cell volume: 2568.6
Cell parameters: 15.044; 32.288; 5.288; 90; 90; 90;  

COD ID: 2101804
CIF file

Original IUCr paper

Formula: - C15 H38 B2 Co F8 N O8 P4 S2 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 3218.9
Cell parameters: 18.154; 12.533; 14.447; 90; 101.69; 90;  

COD ID: 2101805
CIF file

Original IUCr paper

Formula: - C40 H20 N4 S24 -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 4977
Cell parameters: 12.9; 7.74; 49.85; 90; 90.65; 90;  

COD ID: 2101806
CIF file

Original IUCr paper

Formula: - C17 H24 O -
Comments: Marsh, R. E. The perils of <i>Cc</i> revisited Acta Crystallographica Section B 53(2) (1997) 317-322
Space group: C 1 2/c 1
Cell volume: 1411.7
Cell parameters: 9.792; 16.978; 9.371; 90; 115.02; 90;  

COD ID: 2101807
CIF file

Original IUCr paper

Formula: - C80 H112 N8 Ni -
Comments: Helliwell, M.; Deacon, A.; Moon, K. J.; Powell, A. K.; Cook, M. J. Two Crystal Structures Towards the Discotic Columnar Mesophase of (1,4,8,11,15,18,22,25-Octahexylphthalocyaninato)nickel Acta Crystallographica Section B 53(2) (1997) 231-240
Space group: C 1 2/c 1
Cell volume: 14464
Cell parameters: 22.55; 37.14; 18.994; 90; 114.6; 90;  

COD ID: 2101808
CIF file

Original IUCr paper

Formula: - C80 H112 N8 Ni -
Comments: Helliwell, M.; Deacon, A.; Moon, K. J.; Powell, A. K.; Cook, M. J. Two Crystal Structures Towards the Discotic Columnar Mesophase of (1,4,8,11,15,18,22,25-Octahexylphthalocyaninato)nickel Acta Crystallographica Section B 53(2) (1997) 231-240
Space group: P 1 21/n 1
Cell volume: 14186
Cell parameters: 22.347; 37.246; 18.834; 90; 115.185; 90;  

COD ID: 2101809
CIF file

HKL data

Original IUCr paper

Formula: - C13 H11 N3 O4 -
Comments: Khatib, S.; Botoshansky, M.; Eichen, Y. Effects of Crystal Packing on Photoinduced Proton-Transfer Processes of 2,4-Dinitrobenzylpyridine Derivatives Acta Crystallographica Section B 53(2) (1997) 306-316
Space group: P 1 21/c 1
Cell volume: 1283.7
Cell parameters: 11.21; 15.181; 7.734; 90; 102.75; 90;  

COD ID: 2101810
CIF file

Original IUCr paper

Formula: - C13 H11 N3 O4 -
Comments: Khatib, S.; Botoshansky, M.; Eichen, Y. Effects of Crystal Packing on Photoinduced Proton-Transfer Processes of 2,4-Dinitrobenzylpyridine Derivatives Acta Crystallographica Section B 53(2) (1997) 306-316
Space group: P -1
Cell volume: 1310.6
Cell parameters: 10.214; 13.221; 10.068; 92.12; 105.29; 89.55;  

COD ID: 2101811
CIF file

Original IUCr paper

Formula: - C18 H14 N4 O4 -
Comments: Khatib, S.; Botoshansky, M.; Eichen, Y. Effects of Crystal Packing on Photoinduced Proton-Transfer Processes of 2,4-Dinitrobenzylpyridine Derivatives Acta Crystallographica Section B 53(2) (1997) 306-316
Space group: P 1 21/c 1
Cell volume: 1681.4
Cell parameters: 9.941; 11.195; 15.463; 90; 102.29; 90;  

COD ID: 2101812
CIF file

HKL data

Original IUCr paper

Formula: - C42 H36 O3 P2 -
Comments: Fu, T. Y.; Liu, Z.; Olovsson, G.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylphosphine Oxide) Acta Crystallographica Section B 53(2) (1997) 293-299
Space group: P 21 21 21
Cell volume: 3490
Cell parameters: 17.983; 20.682; 9.384; 90; 90; 90;  

COD ID: 2101813
CIF file

HKL data

Original IUCr paper

Formula: - C43 H38 O3 P2 -
Comments: Fu, T. Y.; Liu, Z.; Olovsson, G.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylphosphine Oxide) Acta Crystallographica Section B 53(2) (1997) 293-299
Space group: P 21 21 21
Cell volume: 3561.4
Cell parameters: 18.191; 20.748; 9.436; 90; 90; 90;  

COD ID: 2101814
CIF file

HKL data

Original IUCr paper

Formula: - C43 H38 O3 P2 -
Comments: Fu, T. Y.; Liu, Z.; Olovsson, G.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylphosphine Oxide) Acta Crystallographica Section B 53(2) (1997) 293-299
Space group: P 21 21 21
Cell volume: 3564
Cell parameters: 18.076; 20.904; 9.432; 90; 90; 90;  

COD ID: 2101815
CIF file

HKL data

Original IUCr paper

Formula: - C44 H38 O4 P2 -
Comments: Fu, T. Y.; Liu, Z.; Olovsson, G.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylphosphine Oxide) Acta Crystallographica Section B 53(2) (1997) 293-299
Space group: P 1 21/c 1
Cell volume: 3670.1
Cell parameters: 18.223; 9.435; 21.946; 90; 103.43; 90;  

COD ID: 2101816
CIF file

HKL data

Original IUCr paper

Formula: - C45 H38 O3 -
Comments: Fu, T. Y.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylmethanol) Acta Crystallographica Section B 53(2) (1997) 300-305
Space group: P 1 21/n 1
Cell volume: 3536.2
Cell parameters: 10.21; 21.152; 16.462; 90; 95.916; 90;  

COD ID: 2101817
CIF file

HKL data

Original IUCr paper

Formula: - C44 H38 O3 -
Comments: Fu, T. Y.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylmethanol) Acta Crystallographica Section B 53(2) (1997) 300-305
Space group: P 1 21/n 1
Cell volume: 3429.4
Cell parameters: 13.623; 15.96; 15.95; 90; 98.54; 90;  

COD ID: 2101818
CIF file

HKL data

Original IUCr paper

Formula: - C49 H40 O2 -
Comments: Fu, T. Y.; Scheffer, J. R.; Trotter, J. Structures and Photochemistry of Inclusion Compounds of 9,10-Dihydro-9,10-ethenoanthracene-11,12-bis(diphenylmethanol) Acta Crystallographica Section B 53(2) (1997) 300-305
Space group: P 1 21/c 1
Cell volume: 3679.1
Cell parameters: 10.703; 10.208; 34.057; 90; 98.604; 90;  

COD ID: 2101819
CIF file

Original IUCr paper

Formula: - C20 H45 N5 O4 S2 -
Comments: Li, Q.; Mak, T. C. W. Inclusion Compounds of Thiourea and Peralkylated Ammonium Salts. VI. Hydrogen-Bonded Host Lattices Constructed From Thiourea and Anions of Oxalic Acid and Fumaric Acid Acta Crystallographica Section B 53(2) (1997) 252-261
Space group: P 1 21/n 1
Cell volume: 2811
Cell parameters: 8.854; 9.992; 32.04; 90; 97.34; 90;  

COD ID: 2101820
CIF file

Original IUCr paper

Formula: - C9 H19 N3 O4 S -
Comments: Li, Q.; Mak, T. C. W. Inclusion Compounds of Thiourea and Peralkylated Ammonium Salts. VI. Hydrogen-Bonded Host Lattices Constructed From Thiourea and Anions of Oxalic Acid and Fumaric Acid Acta Crystallographica Section B 53(2) (1997) 252-261
Space group: P -1
Cell volume: 700.1
Cell parameters: 6.269; 8.118; 14.562; 104.79; 91.72; 101.3;  

COD ID: 2101821
CIF file

Original IUCr paper

Formula: - C22 H50 N6 O4 S2 -
Comments: Li, Q.; Mak, T. C. W. Inclusion Compounds of Thiourea and Peralkylated Ammonium Salts. VI. Hydrogen-Bonded Host Lattices Constructed From Thiourea and Anions of Oxalic Acid and Fumaric Acid Acta Crystallographica Section B 53(2) (1997) 252-261
Space group: P 1 21/n 1
Cell volume: 1504.6
Cell parameters: 11.34; 9.293; 14.619; 90; 102.41; 90;  

COD ID: 2101822
CIF file

Original IUCr paper

Formula: - C17 H39 N3 O6 S -
Comments: Li, Q.; Mak, T. C. W. Inclusion Compounds of Thiourea and Peralkylated Ammonium Salts. VI. Hydrogen-Bonded Host Lattices Constructed From Thiourea and Anions of Oxalic Acid and Fumaric Acid Acta Crystallographica Section B 53(2) (1997) 252-261
Space group: P 1 2/n 1
Cell volume: 2384.1
Cell parameters: 16.866; 8.311; 17.603; 90; 104.94; 90;  

COD ID: 2101823
CIF file

Original IUCr paper

Formula: - C10 H28 Cl N5 Se2 -
Comments: Li, Q.; Mak, T. C. W. New Inclusion Compounds of Selenourea with Tetraethyl- and Tetra-<i>n</i>-propylammonium Halides Acta Crystallographica Section B 53(2) (1997) 262-271
Space group: P 1 21/n 1
Cell volume: 1901
Cell parameters: 8.768; 11.036; 19.79; 90; 96.92; 90;  

COD ID: 2101824
CIF file

Original IUCr paper

Formula: - C15 H40 Cl N7 Se3 -
Comments: Li, Q.; Mak, T. C. W. New Inclusion Compounds of Selenourea with Tetraethyl- and Tetra-<i>n</i>-propylammonium Halides Acta Crystallographica Section B 53(2) (1997) 262-271
Space group: C 1 c 1
Cell volume: 2656.6
Cell parameters: 18.091; 13.719; 11.539; 90; 111.93; 90;  

COD ID: 2101825
CIF file

Original IUCr paper

Formula: - C15 H40 Br N7 Se3 -
Comments: Li, Q.; Mak, T. C. W. New Inclusion Compounds of Selenourea with Tetraethyl- and Tetra-<i>n</i>-propylammonium Halides Acta Crystallographica Section B 53(2) (1997) 262-271
Space group: C 1 c 1
Cell volume: 2704.8
Cell parameters: 18.309; 13.807; 11.577; 90; 112.45; 90;  

COD ID: 2101826
CIF file

Original IUCr paper

Formula: - C13 H32 I N3 Se -
Comments: Li, Q.; Mak, T. C. W. New Inclusion Compounds of Selenourea with Tetraethyl- and Tetra-<i>n</i>-propylammonium Halides Acta Crystallographica Section B 53(2) (1997) 262-271
Space group: P 1 21/n 1
Cell volume: 1989.9
Cell parameters: 8.976; 14.455; 15.377; 90; 94.16; 90;  

COD ID: 2101827
CIF file

Original IUCr paper

Formula: - C7 H20 N O4 P -
Comments: Fabry, Jan; Petricek, Vaclav; Kroupa, Jan; Cisarova, Ivana Revision of Ferroelastic Structures of <i>n</i>-Heptyl- and <i>n</i>-Octylammonium Dihydrogen Phosphate Crystals Acta Crystallographica Section B 53(2) (1997) 272-279
Space group: P 1 21/n 1
Cell volume: 2158
Cell parameters: 9.155; 32.074; 7.35; 90; 90.9; 90;  

COD ID: 2101828
CIF file

Original IUCr paper

Formula: - C8 H22 N O4 P -
Comments: Fabry, Jan; Petricek, Vaclav; Kroupa, Jan; Cisarova, Ivana Revision of Ferroelastic Structures of <i>n</i>-Heptyl- and <i>n</i>-Octylammonium Dihydrogen Phosphate Crystals Acta Crystallographica Section B 53(2) (1997) 272-279
Space group: P 1 21/n 1
Cell volume: 2339
Cell parameters: 9.163; 34.677; 7.361; 90; 90.81; 90;  

COD ID: 2101829
CIF file

Original IUCr paper

Formula: - H14 Ni O11 S -
Comments: Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J. Charge Density in Orthorhombic NiSO~4~.7H~2~O at Room Temperature and 25 K Acta Crystallographica Section B 53(3) (1997) 325-336
Space group: P 21 21 21
Cell volume: 951.8
Cell parameters: 6.751; 11.746; 12.003; 90; 90; 90;  

COD ID: 2101830
CIF file

Original IUCr paper

Formula: - H14 Ni O11 S -
Comments: Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J. Charge Density in Orthorhombic NiSO~4~.7H~2~O at Room Temperature and 25 K Acta Crystallographica Section B 53(3) (1997) 325-336
Space group: P 21 21 21
Cell volume: 945
Cell parameters: 6.706; 11.796; 11.949; 90; 90; 90;  

COD ID: 2101831
CIF file

Original IUCr paper

Formula: - H14 Ni O11 S -
Comments: Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J. Charge Density in Orthorhombic NiSO~4~.7H~2~O at Room Temperature and 25 K Acta Crystallographica Section B 53(3) (1997) 325-336
Space group: P 21 21 21
Cell volume: 945
Cell parameters: 6.706; 11.796; 11.949; 90; 90; 90;  

COD ID: 2101832
CIF file

HKL data

Original IUCr paper

Formula: - C21 H28 N2 O2 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols. Chains, Ladders and Sheets Formed by the Adducts of 1,4-Diazabicyclo[2.2.2]octane with Bisphenols: Structures of Adducts with 4,4'-Isopropylidenediphenol (1/1), 4,4'-Oxodiphenol (1/1) and 4,4'-Thiodiphenol (1/1 and 2/1) Acta Crystallographica Section B 53(3) (1997) 513-520
Space group: P 1 2/a 1
Cell volume: 970.3
Cell parameters: 11.385; 6.5565; 13.076; 90; 96.24; 90;  

COD ID: 2101833
CIF file

HKL data

Original IUCr paper

Formula: - C18 H22 N2 O3 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols. Chains, Ladders and Sheets Formed by the Adducts of 1,4-Diazabicyclo[2.2.2]octane with Bisphenols: Structures of Adducts with 4,4'-Isopropylidenediphenol (1/1), 4,4'-Oxodiphenol (1/1) and 4,4'-Thiodiphenol (1/1 and 2/1) Acta Crystallographica Section B 53(3) (1997) 513-520
Space group: P 21 21 21
Cell volume: 1654.5
Cell parameters: 9.4222; 11.1886; 15.694; 90; 90; 90;  

COD ID: 2101834
CIF file

HKL data

Original IUCr paper

Formula: - C18 H22 N2 O2 S -
Comments: Ferguson, George Crystal Engineering Using Bisphenols. Chains, Ladders and Sheets Formed by the Adducts of 1,4-Diazabicyclo[2.2.2]octane with Bisphenols: Structures of Adducts with 4,4'-Isopropylidenediphenol (1/1), 4,4'-Oxodiphenol (1/1) and 4,4'-Thiodiphenol (1/1 and 2/1) Acta Crystallographica Section B 53(3) (1997) 513-520
Space group: P 21 21 21
Cell volume: 1728.7
Cell parameters: 9.5785; 11.4525; 15.759; 90; 90; 90;  

COD ID: 2101835
CIF file

HKL data

Original IUCr paper

Formula: - C30 H32 N2 O4 S2 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols. Chains, Ladders and Sheets Formed by the Adducts of 1,4-Diazabicyclo[2.2.2]octane with Bisphenols: Structures of Adducts with 4,4'-Isopropylidenediphenol (1/1), 4,4'-Oxodiphenol (1/1) and 4,4'-Thiodiphenol (1/1 and 2/1) Acta Crystallographica Section B 53(3) (1997) 513-520
Space group: P 1 21/n 1
Cell volume: 1379.7
Cell parameters: 8.3198; 11.4006; 15.056; 90; 104.955; 90;  

COD ID: 2101836
CIF file

HKL data

Original IUCr paper

Formula: - C18 H22 N4 O2 S -
Comments: Ferguson, George Crystal Engineering Using Bisphenols and Trisphenols. Complexes with Hexamethylenetetramine (HMTA): Strings, Multiple Helices and Chains-of-Rings in the Crystal Structures of the Adducts of HTMA with 4,4'-Thiodiphenol (1/1), 4,4'-Sulfonyldiphenol (1/1), 4,4'-Isopropylidenediphenol (1/1), 1,1,1-Tris(4-hydroxyphenyl)ethane (1/2) and 1,3,5-Trihydroxybenzene (2/3) Acta Crystallographica Section B 53(3) (1997) 521-533
Space group: P m n 21
Cell volume: 880.6
Cell parameters: 15.029; 9.7954; 5.9817; 90; 90; 90;  

COD ID: 2101837
CIF file

HKL data

Original IUCr paper

Formula: - C18 H22 N4 O4 S -
Comments: Ferguson, George Crystal Engineering Using Bisphenols and Trisphenols. Complexes with Hexamethylenetetramine (HMTA): Strings, Multiple Helices and Chains-of-Rings in the Crystal Structures of the Adducts of HTMA with 4,4'-Thiodiphenol (1/1), 4,4'-Sulfonyldiphenol (1/1), 4,4'-Isopropylidenediphenol (1/1), 1,1,1-Tris(4-hydroxyphenyl)ethane (1/2) and 1,3,5-Trihydroxybenzene (2/3) Acta Crystallographica Section B 53(3) (1997) 521-533
Space group: P m n 21
Cell volume: 906.6
Cell parameters: 14.779; 10.2558; 5.9817; 90; 90; 90;  

COD ID: 2101838
CIF file

HKL data

Original IUCr paper

Formula: - C21 H28 N4 O2 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols and Trisphenols. Complexes with Hexamethylenetetramine (HMTA): Strings, Multiple Helices and Chains-of-Rings in the Crystal Structures of the Adducts of HTMA with 4,4'-Thiodiphenol (1/1), 4,4'-Sulfonyldiphenol (1/1), 4,4'-Isopropylidenediphenol (1/1), 1,1,1-Tris(4-hydroxyphenyl)ethane (1/2) and 1,3,5-Trihydroxybenzene (2/3) Acta Crystallographica Section B 53(3) (1997) 521-533
Space group: C 1 2/c 1
Cell volume: 3983.6
Cell parameters: 25.093; 7.1742; 23.612; 90; 110.42; 90;  

COD ID: 2101839
CIF file

Original IUCr paper

Formula: - C32 H42 N8 O3 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols and Trisphenols. Complexes with Hexamethylenetetramine (HMTA): Strings, Multiple Helices and Chains-of-Rings in the Crystal Structures of the Adducts of HTMA with 4,4'-Thiodiphenol (1/1), 4,4'-Sulfonyldiphenol (1/1), 4,4'-Isopropylidenediphenol (1/1), 1,1,1-Tris(4-hydroxyphenyl)ethane (1/2) and 1,3,5-Trihydroxybenzene (2/3) Acta Crystallographica Section B 53(3) (1997) 521-533
Space group: P 21 21 21
Cell volume: 3055.3
Cell parameters: 6.9928; 14.0949; 30.999; 90; 90; 90;  

COD ID: 2101840
CIF file

Original IUCr paper

Formula: - C15 H24 N6 O3 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols and Trisphenols. Complexes with Hexamethylenetetramine (HMTA): Strings, Multiple Helices and Chains-of-Rings in the Crystal Structures of the Adducts of HTMA with 4,4'-Thiodiphenol (1/1), 4,4'-Sulfonyldiphenol (1/1), 4,4'-Isopropylidenediphenol (1/1), 1,1,1-Tris(4-hydroxyphenyl)ethane (1/2) and 1,3,5-Trihydroxybenzene (2/3) Acta Crystallographica Section B 53(3) (1997) 521-533
Space group: C 1 2/c 1
Cell volume: 3251.3
Cell parameters: 23.598; 7.136; 19.445; 90; 96.822; 90;  

COD ID: 2101841
CIF file

HKL data

Original IUCr paper

Formula: - C20 H18 O3 -
Comments: Ferguson, George Crystal Engineering Using Trisphenols. Three-Dimensional Hydrogen-Bonding Networks in 1,1,1-Tris(4-hydroxyphenyl)ethane, its Hydrated Adduct with 1,4-Diazabicyclo[2.2.2]octane (1/1/1) and its Adduct with Piperazine (4/3) Acta Crystallographica Section B 53(3) (1997) 534-543
Space group: I 1 a 1
Cell volume: 1623.9
Cell parameters: 7.9781; 18.558; 11.1995; 90; 101.668; 90;  

COD ID: 2101842
CIF file

Original IUCr paper

Formula: - C26 H32 N2 O4 -
Comments: Ferguson, George Crystal Engineering Using Trisphenols. Three-Dimensional Hydrogen-Bonding Networks in 1,1,1-Tris(4-hydroxyphenyl)ethane, its Hydrated Adduct with 1,4-Diazabicyclo[2.2.2]octane (1/1/1) and its Adduct with Piperazine (4/3) Acta Crystallographica Section B 53(3) (1997) 534-543
Space group: P -1
Cell volume: 1149.5
Cell parameters: 10.421; 10.734; 10.9756; 76.645; 74.513; 89.305;  

COD ID: 2101843
CIF file

Original IUCr paper

Formula: - C92 H102 N6 O12 -
Comments: Ferguson, George Crystal Engineering Using Trisphenols. Three-Dimensional Hydrogen-Bonding Networks in 1,1,1-Tris(4-hydroxyphenyl)ethane, its Hydrated Adduct with 1,4-Diazabicyclo[2.2.2]octane (1/1/1) and its Adduct with Piperazine (4/3) Acta Crystallographica Section B 53(3) (1997) 534-543
Space group: P -1
Cell volume: 1976.1
Cell parameters: 12.5049; 12.7046; 14.6226; 113.738; 100.839; 102.438;  

COD ID: 2101844
CIF file

Original IUCr paper

Formula: - Mn8 Sn5 -
Comments: Ponten, Margareta Elding; Stenberg, Lars; Lidin, Sven; Madariaga, Gotzon; Perez-Mato, Juan-Manuel Structure of Mn~8~Sn~5~ Acta Crystallographica Section B 53(3) (1997) 364-372
Space group: P b n m
Cell volume: 920.05
Cell parameters: 21.9114; 7.6003; 5.5247; 90; 90; 90;  

COD ID: 2101845
CIF file

Original IUCr paper

Formula: - Li Nb O3 -
Comments: Hsu, R.; Maslen, E. N.; du Boulay, D.; Ishizawa, N. Synchrotron X-ray Studies of LiNbO~3~ and LiTaO~3~ Acta Crystallographica Section B 53(3) (1997) 420-428
Space group: R 3 c :H
Cell volume: 318.2
Cell parameters: 5.148; 5.148; 13.863; 90; 90; 120;  

COD ID: 2101846
CIF file

Original IUCr paper

Formula: - Li O3 Ta -
Comments: Hsu, R.; Maslen, E. N.; du Boulay, D.; Ishizawa, N. Synchrotron X-ray Studies of LiNbO~3~ and LiTaO~3~ Acta Crystallographica Section B 53(3) (1997) 420-428
Space group: R 3 c :H
Cell volume: 317.1
Cell parameters: 5.154; 5.154; 13.783; 90; 90; 120;  

COD ID: 2101847
CIF file

HKL data

Original IUCr paper

Formula: - C2 H9 N11 O8 -
Comments: Pinkerton, A. Alan Energetic Materials: The Preparation and Structural Characterization of Three Biguanidinium Dinitramides Acta Crystallographica Section B 53(3) (1997) 504-512
Space group: C 1 2/c 1
Cell volume: 1135.1
Cell parameters: 11.892; 8.131; 13.038; 90; 115.79; 90;  

COD ID: 2101848
CIF file

Original IUCr paper

Formula: - C2 H8 N8 O4 -
Comments: Pinkerton, A. Alan Energetic Materials: The Preparation and Structural Characterization of Three Biguanidinium Dinitramides Acta Crystallographica Section B 53(3) (1997) 504-512
Space group: P -1
Cell volume: 426.82
Cell parameters: 4.3686; 9.404; 10.742; 83.54; 80.386; 79.93;  

COD ID: 2101849
CIF file

Original IUCr paper

Formula: - C2 H11 N11 O9 -
Comments: Pinkerton, A. Alan Energetic Materials: The Preparation and Structural Characterization of Three Biguanidinium Dinitramides Acta Crystallographica Section B 53(3) (1997) 504-512
Space group: P 21 21 21
Cell volume: 1255.4
Cell parameters: 6.4201; 13.408; 14.584; 90; 90; 90;  

COD ID: 2101850
CIF file

Original IUCr paper

Formula: - C12 H10 Pb S2 -
Comments: Rae, A. D.; Craig, D. C.; Dance, I. G.; Scudder, M. L.; Dean, P. A. W.; Kmetic, M. A.; Payne, N. C.; Vittal, J. J. The Pseudo-Symmetric Structure of Pb(SPh)~2~ Acta Crystallographica Section B 53(3) (1997) 457-465
Space group: C 1 1 21/d
Cell volume: 4611.7
Cell parameters: 54.06; 11.468; 7.4387; 90; 90; 90;  

COD ID: 2101851
CIF file

Original IUCr paper

Formula: - Ge O2 -
Comments: Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J. Structural Studies of Rutile-Type Metal Dioxides Acta Crystallographica Section B 53(3) (1997) 373-380
Space group: P 42/m n m
Cell volume: 55.5709
Cell parameters: 4.40656; 4.40656; 2.86186; 90; 90; 90;  

COD ID: 2101853
CIF file

Original IUCr paper

Formula: - O2 Sn -
Comments: Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J. Structural Studies of Rutile-Type Metal Dioxides Acta Crystallographica Section B 53(3) (1997) 373-380
Space group: P 42/m n m
Cell volume: 71.511
Cell parameters: 4.73735; 4.73735; 3.1864; 90; 90; 90;  

COD ID: 2101854
CIF file

Original IUCr paper

Formula: - Ir O2 -
Comments: Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J. Structural Studies of Rutile-Type Metal Dioxides Acta Crystallographica Section B 53(3) (1997) 373-380
Space group: P 42/m n m
Cell volume: 64.107
Cell parameters: 4.5051; 4.5051; 3.1586; 90; 90; 90;  

COD ID: 2101855
CIF file

Original IUCr paper

Formula: - H2 Mg3 O10 S2 -
Comments: Fleet, Michael E.; Knipe, Stephen W. Structure of Magnesium Hydroxide Sulfate [2MgSO~4~.Mg(OH)~2~], and Solid Solution in Magnesium Hydroxide Sulfate Hydrate and Caminite Acta Crystallographica, Section B 53(3) (1997) 358-363
Space group: P 43 21 2
Cell volume: 716
Cell parameters: 7.454; 7.454; 12.885; 90; 90; 90;  

COD ID: 2101856
CIF file

Original IUCr paper

Formula: - Cl2 Co H15 N6 O2 -
Comments: Boldyreva, E.; Kivikoski, J.; Howard, J. A. K. Distortion of Crystal Structures of Some Co^III^ Ammine Complexes. II. Distortion of Crystal Structures of [Co(NH~3~)~5~NO~2~]<i>X</i>~2~ (<i>X</i> = Cl, Br) on Cooling Acta Crystallographica Section B 53(3) (1997) 405-414
Space group: C 1 2/c 1
Cell volume: 962.2
Cell parameters: 10.338; 8.687; 10.756; 90; 95.05; 90;  

COD ID: 2101857
CIF file

Original IUCr paper

Formula: - Cl2 Co H15 N6 O2 -
Comments: Boldyreva, E.; Kivikoski, J.; Howard, J. A. K. Distortion of Crystal Structures of Some Co^III^ Ammine Complexes. II. Distortion of Crystal Structures of [Co(NH~3~)~5~NO~2~]<i>X</i>~2~ (<i>X</i> = Cl, Br) on Cooling Acta Crystallographica Section B 53(3) (1997) 405-414
Space group: C 1 2/c 1
Cell volume: 950.6
Cell parameters: 10.215; 8.697; 10.748; 90; 95.41; 90;  

COD ID: 2101858
CIF file

Original IUCr paper

Formula: - Br2 Co H15 N6 O2 -
Comments: Boldyreva, E.; Kivikoski, J.; Howard, J. A. K. Distortion of Crystal Structures of Some Co^III^ Ammine Complexes. II. Distortion of Crystal Structures of [Co(NH~3~)~5~NO~2~]<i>X</i>~2~ (<i>X</i> = Cl, Br) on Cooling Acta Crystallographica Section B 53(3) (1997) 405-414
Space group: C 1 2/c 1
Cell volume: 1033.9
Cell parameters: 10.68; 8.838; 10.99; 90; 94.7; 90;  

COD ID: 2101859
CIF file

Original IUCr paper

Formula: - Br2 Co H15 N6 O2 -
Comments: Boldyreva, E.; Kivikoski, J.; Howard, J. A. K. Distortion of Crystal Structures of Some Co^III^ Ammine Complexes. II. Distortion of Crystal Structures of [Co(NH~3~)~5~NO~2~]<i>X</i>~2~ (<i>X</i> = Cl, Br) on Cooling Acta Crystallographica Section B 53(3) (1997) 405-414
Space group: C 1 2/c 1
Cell volume: 1018.8
Cell parameters: 10.575; 8.815; 10.97; 90; 94.97; 90;  

COD ID: 2101860
CIF file

HKL data

Original IUCr paper

Formula: - C6 H14 N2 O6 -
Comments: André, C.; Luger, P.; Fuhrhop, J.-H.; Hahn, F. Hydrogen-Bonding Schemes of Galactonic Acid Hydrazide and its Hemihydrate Acta Crystallographica Section B 53(3) (1997) 490-497
Space group: P 1 21 1
Cell volume: 446.65
Cell parameters: 5.7444; 17.314; 4.6903; 90; 106.77; 90;  

COD ID: 2101861
CIF file

HKL data

Original IUCr paper

Formula: - C12 H30 N4 O13 -
Comments: André, C.; Luger, P.; Fuhrhop, J.-H.; Hahn, F. Hydrogen-Bonding Schemes of Galactonic Acid Hydrazide and its Hemihydrate Acta Crystallographica Section B 53(3) (1997) 490-497
Space group: P 1 21 1
Cell volume: 952.3
Cell parameters: 4.78; 13.603; 14.822; 90; 98.83; 90;  

COD ID: 2101862
CIF file

Original IUCr paper

Formula: - C5 H8 N4 O5 -
Comments: Artioli, G.; Masciocchi, N.; Galli, E. The Elusive Crystal Structure of Uric Acid Dihydrate: Implication for Epitaxial Growth During Biomineralization Acta Crystallographica Section B 53(3) (1997) 498-503
Space group: P n a b
Cell volume: 823.3
Cell parameters: 7.409; 17.549; 6.332; 90; 90; 90;  

COD ID: 2101863
CIF file

Original IUCr paper

Formula: - C38 H30 Cl2 Co N8 -
Comments: Kawamura, Y.; Yamauchi, J.; Azuma, N. Molecular and Crystal Structure of the Complex Composed of 2,3,5-Triphenyltetrazolium Cation and Dichloro-(1,3,5-triphenylformazanato)cobaltate(II) Anion Acta Crystallographica Section B 53(3) (1997) 451-456
Space group: P -1
Cell volume: 1744.2
Cell parameters: 10.214; 18.208; 9.985; 96.44; 107.92; 81.79;  

COD ID: 2101864
CIF file

Original IUCr paper

Formula: - Cu12 S13 Sb4 -
Comments: Pfitzner, A.; Evain, M.; Petricek, V. Cu~12~Sb~4~S~13~: A Temperature-Dependent Structure Investigation Acta Crystallographica Section B 53(3) (1997) 337-345
Space group: I -4 3 m
Cell volume: 1102.08
Cell parameters: 10.3293; 10.3293; 10.3293; 90; 90; 90;  

COD ID: 2101865
CIF file

Original IUCr paper

Formula: - Cu12 S13 Sb4 -
Comments: Pfitzner, A.; Evain, M.; Petricek, V. Cu~12~Sb~4~S~13~: A Temperature-Dependent Structure Investigation Acta Crystallographica Section B 53(3) (1997) 337-345
Space group: I -4 3 m
Cell volume: 1114.45
Cell parameters: 10.3678; 10.3678; 10.3678; 90; 90; 90;  

COD ID: 2101866
CIF file

Original IUCr paper

Formula: - Al11 Li0.75 Na0.47 O17.11 -
Comments: Edström, Kristina; Gustafsson Torbjörn; Thomas, John, O. Li^+^/Na^+^ β-Alumina: A Combined Single-Crystal Neutron and X-ray Diffraction Study Acta Crystallographica Section B 53(4) (1997) 631-638
Space group: P 63/m m c
Cell volume: 613.11
Cell parameters: 5.59; 5.59; 22.656; 90; 90; 120;  

COD ID: 2101867
CIF file

Original IUCr paper

Formula: - Al11 Li0.75 Na0.47 O17.11 -
Comments: Edström, Kristina; Gustafsson Torbjörn; Thomas, John, O. Li^+^/Na^+^ β-Alumina: A Combined Single-Crystal Neutron and X-ray Diffraction Study Acta Crystallographica Section B 53(4) (1997) 631-638
Space group: P 63/m m c
Cell volume: 613.64
Cell parameters: 5.5929; 5.5929; 22.652; 90; 90; 120;  

COD ID: 2101868
CIF file

Original IUCr paper

Formula: - Li2 Mo O3 -
Comments: Hibble, S. J.; Fawcett, I. D.; Hannon, A. C. Structure of Two Disordered Molybdates, Li~2~Mo^IV^O~3~ and Li~4~Mo~3~^IV^O~8~, from Total Neutron Scattering Acta Crystallographica Section B 53(4) (1997) 604-612
Space group: R -3 m :H
Cell volume: 107
Cell parameters: 2.878; 2.878; 14.9119; 90; 90; 120;  

COD ID: 2101869
CIF file

Original IUCr paper

Formula: - Li4 Mo3 O8 -
Comments: Hibble, S. J.; Fawcett, I. D.; Hannon, A. C. Structure of Two Disordered Molybdates, Li~2~Mo^IV^O~3~ and Li~4~Mo~3~^IV^O~8~, from Total Neutron Scattering Acta Crystallographica Section B 53(4) (1997) 604-612
Space group: R -3 m :H
Cell volume: 109.65
Cell parameters: 2.8688; 2.8688; 15.3843; 90; 90; 120;  

COD ID: 2101870
CIF file

Original IUCr paper

Formula: - Li4 Mo3 O8 -
Comments: Hibble, S. J.; Fawcett, I. D.; Hannon, A. C. Structure of Two Disordered Molybdates, Li~2~Mo^IV^O~3~ and Li~4~Mo~3~^IV^O~8~, from Total Neutron Scattering Acta Crystallographica Section B 53(4) (1997) 604-612
Space group: R -3 m :H
Cell volume: 877.306
Cell parameters: 5.738; 5.738; 30.768; 90; 90; 120;  

COD ID: 2101871
CIF file

Original IUCr paper

Formula: - Li2 Mo O3 -
Comments: Hibble, S. J.; Fawcett, I. D.; Hannon, A. C. Structure of Two Disordered Molybdates, Li~2~Mo^IV^O~3~ and Li~4~Mo~3~^IV^O~8~, from Total Neutron Scattering Acta Crystallographica Section B 53(4) (1997) 604-612
Space group: R -3 m :H
Cell volume: 855.435
Cell parameters: 5.755; 5.755; 29.824; 90; 90; 120;  

COD ID: 2101872
CIF file

Original IUCr paper

Formula: - C27 H30 N2 O4 -
Comments: Gjerløv, A.; Larsen, S. A Study of Diastereomeric Mandelate Salts of Cinchonidine and the Relation to Their Quasidiastereomeric Analogues Acta Crystallographica Section B 53(4) (1997) 708-718
Space group: C 1 2 1
Cell volume: 2263.6
Cell parameters: 21.4; 6.2777; 17.853; 90; 109.304; 90;  

COD ID: 2101873
CIF file

Original IUCr paper

Formula: - C27 H30 N2 O4 -
Comments: Gjerløv, A.; Larsen, S. A Study of Diastereomeric Mandelate Salts of Cinchonidine and the Relation to Their Quasidiastereomeric Analogues Acta Crystallographica Section B 53(4) (1997) 708-718
Space group: P 1 21 1
Cell volume: 2319.2
Cell parameters: 6.41; 32.808; 11.222; 90; 100.67; 90;  

COD ID: 2101874
CIF file

Original IUCr paper

Formula: - C9 H15 N O2 -
Comments: Maurin, Jan K.; Czarnocki, Zbigniew; Paluchowska, Beata; Winnicka-Maurin, Małgorzata Conformation-Related Reaction Efficiency of Glutarimides with Phenyllithium. Structures of 3,3,5,5-Tetramethylglutarimide and 2-Hydroxy-2-phenyl-3,3,5,5-tetramethyl-6-piperidone. X-ray and Theoretical Study Acta Crystallographica Section B 53(4) (1997) 719-725
Space group: P 1 21/c 1
Cell volume: 968.6
Cell parameters: 7.715; 11.136; 11.707; 90; 105.63; 90;  

COD ID: 2101875
CIF file

Original IUCr paper

Formula: - C15 H21 N O2 -
Comments: Maurin, Jan K.; Czarnocki, Zbigniew; Paluchowska, Beata; Winnicka-Maurin, Małgorzata Conformation-Related Reaction Efficiency of Glutarimides with Phenyllithium. Structures of 3,3,5,5-Tetramethylglutarimide and 2-Hydroxy-2-phenyl-3,3,5,5-tetramethyl-6-piperidone. X-ray and Theoretical Study Acta Crystallographica Section B 53(4) (1997) 719-725
Space group: P -1
Cell volume: 678.84
Cell parameters: 6.1685; 11.1475; 11.526; 117.1; 103.39; 91.288;  

COD ID: 2101876
CIF file

Original IUCr paper

Formula: - C7 H3 Cl5 -
Comments: Brock, C. P.; Fu, Y. Pentachlorotoluene: Rotational and Compositional Disorder Acta Crystallographica Section B 53(4) (1997) 613-619
Space group: P 1 21/n 1
Cell volume: 463.01
Cell parameters: 8.09; 3.8472; 14.883; 90; 91.73; 90;  

COD ID: 2101877
CIF file

Original IUCr paper

Formula: - C7 H3 Cl5 -
Comments: Brock, C. P.; Fu, Y. Pentachlorotoluene: Rotational and Compositional Disorder Acta Crystallographica Section B 53(4) (1997) 613-619
Space group: P 1 21/n 1
Cell volume: 465.8
Cell parameters: 8.102; 3.857; 14.913; 90; 91.78; 90;  

COD ID: 2101878
CIF file

Original IUCr paper

Formula: - Cl2 H12 O14 Zn -
Comments: Soma Ghosh; Monika Mukherjee; Alpana Seal; Siddhartha Ray X-ray Study of <i>M</i>^II^(ClO~4~)~2~.6H~2~O (<i>M</i>^II^ = Zn, Ni): Twinning, Disorder and Phase Transitions Acta Crystallographica Section B 53(4) (1997) 639-644
Space group: P 63 m c
Cell volume: 279.13
Cell parameters: 7.7959; 7.7959; 5.3033; 90; 90; 120;  

COD ID: 2101879
CIF file

Original IUCr paper

Formula: - C10 H14 O -
Comments: Sañé, J.; Ruis, J.; Calvet, T.; Cuevas-Diarte, M. A. Chiral Molecular Alloys: Patterson-Search Structure Determination of <small>L</small>-Carvone and <small>DL</small>-Carvone from X-ray Powder Diffraction Data at 218 K Acta Crystallographica Section B 53(4) (1997) 702-707
Space group: P 21 21 21
Cell volume: 943.5
Cell parameters: 6.8576; 6.8831; 19.988; 90; 90; 90;  

COD ID: 2101880
CIF file

Original IUCr paper

Formula: - C10 H14 O -
Comments: Sañé, J.; Ruis, J.; Calvet, T.; Cuevas-Diarte, M. A. Chiral Molecular Alloys: Patterson-Search Structure Determination of <small>L</small>-Carvone and <small>DL</small>-Carvone from X-ray Powder Diffraction Data at 218 K Acta Crystallographica Section B 53(4) (1997) 702-707
Space group: P c m n
Cell volume: 951.6
Cell parameters: 6.9744; 6.8094; 20.038; 90; 90; 90;  

COD ID: 2101881
CIF file

Original IUCr paper

Formula: - C42 H30 Cu2 N2 O12 -
Comments: Harada, A.; Tsuchimoto, M.; Ohba, S.; Iwasawa, K.; Tokii, T. Structures and Magnetic Properties of Dimeric Copper(II) Benzoylformates Acta Crystallographica Section B 53(4) (1997) 654-661
Space group: P 1 21/n 1
Cell volume: 1956.7
Cell parameters: 10.014; 10.383; 18.845; 90; 92.99; 90;  

COD ID: 2101882
CIF file

Original IUCr paper

Formula: - C44 H34 Cu2 N2 O12 -
Comments: Harada, A.; Tsuchimoto, M.; Ohba, S.; Iwasawa, K.; Tokii, T. Structures and Magnetic Properties of Dimeric Copper(II) Benzoylformates Acta Crystallographica Section B 53(4) (1997) 654-661
Space group: P 1 21/c 1
Cell volume: 2069.1
Cell parameters: 9.641; 19.695; 10.976; 90; 96.89; 90;  

COD ID: 2101883
CIF file

Original IUCr paper

Formula: - C50 H40 Cu2 N2 O12 -
Comments: Harada, A.; Tsuchimoto, M.; Ohba, S.; Iwasawa, K.; Tokii, T. Structures and Magnetic Properties of Dimeric Copper(II) Benzoylformates Acta Crystallographica Section B 53(4) (1997) 654-661
Space group: P 1 21/c 1
Cell volume: 4660.3
Cell parameters: 21.267; 10.568; 21.45; 90; 104.83; 90;  

COD ID: 2101884
CIF file

Original IUCr paper

Formula: - C44 H34 Cu2 N2 O12 -
Comments: Harada, A.; Tsuchimoto, M.; Ohba, S.; Iwasawa, K.; Tokii, T. Structures and Magnetic Properties of Dimeric Copper(II) Benzoylformates Acta Crystallographica Section B 53(4) (1997) 654-661
Space group: C 1 2/c 1
Cell volume: 4159
Cell parameters: 19.083; 12.156; 21.692; 90; 124.26; 90;  

COD ID: 2101885
CIF file

Original IUCr paper

Formula: - C58 H52 Cl2 Cu2 N2 O12 -
Comments: Harada, A.; Tsuchimoto, M.; Ohba, S.; Iwasawa, K.; Tokii, T. Structures and Magnetic Properties of Dimeric Copper(II) Benzoylformates Acta Crystallographica Section B 53(4) (1997) 654-661
Space group: P 1 21/n 1
Cell volume: 2756.2
Cell parameters: 14.332; 10.855; 17.719; 90; 91; 90;  

COD ID: 2101886
CIF file

Original IUCr paper

Formula: - C60 H52 Cu2 N8 O16 -
Comments: Harada, A.; Tsuchimoto, M.; Ohba, S.; Iwasawa, K.; Tokii, T. Structures and Magnetic Properties of Dimeric Copper(II) Benzoylformates Acta Crystallographica Section B 53(4) (1997) 654-661
Space group: P -1
Cell volume: 1495.7
Cell parameters: 12.707; 13.139; 9.488; 93.92; 97.81; 72.45;  

COD ID: 2101887
CIF file

Original IUCr paper

Formula: - C12 H10 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P 1 21/a 1
Cell volume: 992.7
Cell parameters: 12.184; 5.7888; 15.2282; 90; 112.44; 90;  

COD ID: 2101888
CIF file

Original IUCr paper

Formula: - C12 H10 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P 1 21/a 1
Cell volume: 992.7
Cell parameters: 12.184; 5.7888; 15.2282; 90; 112.44; 90;  

COD ID: 2101889
CIF file

HKL data

Original IUCr paper

Formula: - C12 H10 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P 1 21/a 1
Cell volume: 948.9
Cell parameters: 12.034; 5.695; 14.979; 90; 112.436; 90;  

COD ID: 2101890
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: C 1 2/c 1
Cell volume: 1196.1
Cell parameters: 13.625; 6.3728; 13.8825; 90; 97.11; 90;  

COD ID: 2101891
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: C 1 2/c 1
Cell volume: 1142.3
Cell parameters: 13.4663; 6.294; 13.6133; 90; 98.116; 90;  

COD ID: 2101892
CIF file

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P b c a
Cell volume: 1223.6
Cell parameters: 13.819; 11.805; 7.501; 90; 90; 90;  

COD ID: 2101893
CIF file

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P b c a
Cell volume: 1223.6
Cell parameters: 13.819; 11.805; 7.501; 90; 90; 90;  

COD ID: 2101894
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P b c a
Cell volume: 1194.5
Cell parameters: 13.824; 11.731; 7.366; 90; 90; 90;  

COD ID: 2101895
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P 21 21 21
Cell volume: 1166
Cell parameters: 11.652; 13.82; 7.241; 90; 90; 90;  

COD ID: 2101896
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P 1 21/a 1
Cell volume: 564.09
Cell parameters: 11.9762; 4.8462; 9.7193; 90; 89.654; 90;  

COD ID: 2101897
CIF file

HKL data

Original IUCr paper

Formula: - C14 H14 N2 -
Comments: Harada, J.; Ogawa, K.; Tomoda, S. Molecular Motion and Conformational Interconversion of Azobenzenes in Crystals as Studied by X-ray Diffraction Acta Crystallographica Section B 53(4) (1997) 662-672
Space group: P 1 21/a 1
Cell volume: 542.6
Cell parameters: 11.819; 4.781; 9.602; 90; 89.87; 90;  

COD ID: 2101898
CIF file

Original IUCr paper

Formula: - C6 H6 Ag Cl O4 -
Comments: McMullan, R. K.; Koetzle, T. F.; Fritchie, Jnr, C. J. Low-Temperature Neutron Diffraction Study of the Silver Perchlorate‒Benzene π Complex Acta Crystallographica Section B 53(4) (1997) 645-653
Space group: C m c m
Cell volume: 731.6
Cell parameters: 7.913; 7.837; 11.798; 90; 90; 90;  

COD ID: 2101899
CIF file

Original IUCr paper

Formula: - C6 H6 Ag Cl O4 -
Comments: McMullan, R. K.; Koetzle, T. F.; Fritchie, Jnr, C. J. Low-Temperature Neutron Diffraction Study of the Silver Perchlorate‒Benzene π Complex Acta Crystallographica Section B 53(4) (1997) 645-653
Space group: C m c m
Cell volume: 737.76
Cell parameters: 7.973; 7.857; 11.777; 90; 90; 90;  

COD ID: 2101900
CIF file

Original IUCr paper

Formula: - C6 H6 Ag Cl O4 -
Comments: McMullan, R. K.; Koetzle, T. F.; Fritchie, Jnr, C. J. Low-Temperature Neutron Diffraction Study of the Silver Perchlorate‒Benzene π Complex Acta Crystallographica Section B 53(4) (1997) 645-653
Space group: C m c m
Cell volume: 751.37
Cell parameters: 8.1; 7.902; 11.739; 90; 90; 90;  

COD ID: 2101901
CIF file

Original IUCr paper

Formula: - K3 Mo2 Na O8 -
Comments: Fábry, J.; Petrícek, V.; Vanek, P.; Císarová, I. Phase Transition in K~3~Na(MoO~4~)~2~ and Determination of the Twinned Structures of K~3~Na(MoO~4~)~2~ and K~2.5~Na~1.5~(MoO~4~)~2~ at Room Temperature Acta Crystallographica Section B 53(4) (1997) 596-603
Space group: C 1 2/c 1
Cell volume: 960
Cell parameters: 10.4455; 6.0307; 15.24; 90; 90; 90;  

COD ID: 2101902
CIF file

Original IUCr paper

Formula: - K2.5 Mo2 Na1.5 O8 -
Comments: Fábry, J.; Petrícek, V.; Vanek, P.; Císarová, I. Phase Transition in K~3~Na(MoO~4~)~2~ and Determination of the Twinned Structures of K~3~Na(MoO~4~)~2~ and K~2.5~Na~1.5~(MoO~4~)~2~ at Room Temperature Acta Crystallographica Section B 53(4) (1997) 596-603
Space group: C 1 2/c 1
Cell volume: 936.6
Cell parameters: 10.3849; 5.9957; 15.043; 90; 90; 90;  

COD ID: 2101903
CIF file

Original IUCr paper

Formula: - Al12 Cr Fe2 -
Comments: Sui, H. X.; Liao, X. Z.; Kuo, K. H.; Zou, X.; Hovmöller, S. Structural Model of the Orthorhombic Non-Fibonacci Approximant in the Al~12~Fe~2~Cr Alloy Acta Crystallographica Section B 53(4) (1997) 587-595
Space group: I m m 2
Cell volume: 4702.91
Cell parameters: 12.34; 12.41; 30.71; 90; 90; 90;  

COD ID: 2101904
CIF file

Original IUCr paper

Formula: - C9 H9 Cl O3 -
Comments: Sine Larsen; Katalin Marthi Structural and Thermodynamic Relationships Between Optically Active and Racemic Compounds. The Crystal Structures of Optically Active Chloro- and Bromo-Substituted 3-Hydroxy-3-phenylpropionic Acids Acta Crystallographica Section B 53(5) (1997) 803-811
Space group: P 21 21 21
Cell volume: 892
Cell parameters: 5.6938; 5.7913; 27.052; 90; 90; 90;  

COD ID: 2101905
CIF file

Original IUCr paper

Formula: - C9 H9 Br O3 -
Comments: Sine Larsen; Katalin Marthi Structural and Thermodynamic Relationships Between Optically Active and Racemic Compounds. The Crystal Structures of Optically Active Chloro- and Bromo-Substituted 3-Hydroxy-3-phenylpropionic Acids Acta Crystallographica Section B 53(5) (1997) 803-811
Space group: P 21 21 21
Cell volume: 930.3
Cell parameters: 5.802; 5.8638; 27.345; 90; 90; 90;  

COD ID: 2101906
CIF file

Original IUCr paper

Formula: - Cl5 Cr2 H33 N10 O2 -
Comments: Harris, P.; Birkedal, H.; Larsen, S.; Güdel, H. U. A New Study of the Acid Rhodo Complex Salt [(NH~3~)~5~CrOHCr(NH~3~)~5~]Cl~5~.H~2~O Shows That the Crystals are Orthorhombic Acta Crystallographica Section B 53(5) (1997) 795-802
Space group: P 21 21 21
Cell volume: 3849
Cell parameters: 16.155; 16.154; 14.75; 90; 90; 90;  

COD ID: 2101907
CIF file

Original IUCr paper

Formula: - C18 H24 N4 -
Comments: Cole, J. C.; Cole, J. M.; Cross, G. H.; Farsari, M.; Howard, J. A. K.; Szablewski, M. Structural Studies of a Series of Organic Non-Linear Optical Materials Acta Crystallographica Section B 53(5) (1997) 812-821
Space group: P 1 21/c 1
Cell volume: 1679.5
Cell parameters: 11.262; 12.867; 12.51; 90; 112.11; 90;  

COD ID: 2101908
CIF file

Original IUCr paper

Formula: - C17 H16 N4 -
Comments: Cole, J. C.; Cole, J. M.; Cross, G. H.; Farsari, M.; Howard, J. A. K.; Szablewski, M. Structural Studies of a Series of Organic Non-Linear Optical Materials Acta Crystallographica Section B 53(5) (1997) 812-821
Space group: P 1 n 1
Cell volume: 720.5
Cell parameters: 6.97; 14.233; 7.633; 90; 107.91; 90;  

COD ID: 2101909
CIF file

Original IUCr paper

Formula: - C15 H12 N4 -
Comments: Cole, J. C.; Cole, J. M.; Cross, G. H.; Farsari, M.; Howard, J. A. K.; Szablewski, M. Structural Studies of a Series of Organic Non-Linear Optical Materials Acta Crystallographica Section B 53(5) (1997) 812-821
Space group: P 1 21/n 1
Cell volume: 1265.1
Cell parameters: 6.837; 25.08; 7.386; 90; 92.7; 90;  

COD ID: 2101910
CIF file

Original IUCr paper

Formula: - C18 H15 N5 -
Comments: Cole, J. C.; Cole, J. M.; Cross, G. H.; Farsari, M.; Howard, J. A. K.; Szablewski, M. Structural Studies of a Series of Organic Non-Linear Optical Materials Acta Crystallographica Section B 53(5) (1997) 812-821
Space group: P -1
Cell volume: 779.7
Cell parameters: 7.615; 7.962; 14.74; 91.45; 96.93; 118.03;  

COD ID: 2101911
CIF file

Original IUCr paper

Formula: - C10 H44 N4 O14 P2 -
Comments: Cohen, A. E.; Craven, B. M.; Klooster, W. T. Structure and Thermal Vibrations of Spermine Phosphate Hexahydrate from Neutron Diffraction Data at 125K Acta Crystallographica Section B 53(5) (1997) 787-794
Space group: P 1 21/a 1
Cell volume: 1155.3
Cell parameters: 7.931; 23.158; 6.856; 90; 113.44; 90;  

COD ID: 2101912
CIF file

Original IUCr paper

Formula: - C11 H15 O4 P -
Comments: Blazis, Vincent J.; Koeller, Kevin J.; Rath, Nigam P.; Spilling, Christopher D. Application of Wallach's Rule in a Comparison of the X-ray Crystal Structures of the Racemate and the (<i>S</i>) Enantiomer of (1-Hydroxy-3-phenyl-2-propenyl) Dimethylphosphonate Acta Crystallographica Section B 53(5) (1997) 838-842
Space group: P 1 21/c 1
Cell volume: 1181.94
Cell parameters: 10.1737; 13.9127; 8.7336; 90; 107.037; 90;  

COD ID: 2101913
CIF file

Original IUCr paper

Formula: - C11 H15 O4 P -
Comments: Blazis, Vincent J.; Koeller, Kevin J.; Rath, Nigam P.; Spilling, Christopher D. Application of Wallach's Rule in a Comparison of the X-ray Crystal Structures of the Racemate and the (<i>S</i>) Enantiomer of (1-Hydroxy-3-phenyl-2-propenyl) Dimethylphosphonate Acta Crystallographica Section B 53(5) (1997) 838-842
Space group: P 21 21 21
Cell volume: 1254.59
Cell parameters: 7.36; 8.344; 20.4292; 90; 90; 90;  

COD ID: 2101914
CIF file

HKL data

Original IUCr paper

Formula: - C48 H40 B P -
Comments: Lloyd, M. A.; Brock, C. P. [<i>M</i>Ph~4~][BPh~4~], <i>M</i> = P, As and Sb Acta Crystallographica Section B 53(5) (1997) 773-779
Space group: I -4
Cell volume: 3542.6
Cell parameters: 15.796; 15.796; 14.198; 90; 90; 90;  

COD ID: 2101915
CIF file

HKL data

Original IUCr paper

Formula: - C48 H40 As B -
Comments: Lloyd, M. A.; Brock, C. P. [<i>M</i>Ph~4~][BPh~4~], <i>M</i> = P, As and Sb Acta Crystallographica Section B 53(5) (1997) 773-779
Space group: I -4
Cell volume: 3571.1
Cell parameters: 15.936; 15.936; 14.062; 90; 90; 90;  

COD ID: 2101916
CIF file

HKL data

Original IUCr paper

Formula: - C48 H40 B Sb -
Comments: Lloyd, M. A.; Brock, C. P. [<i>M</i>Ph~4~][BPh~4~], <i>M</i> = P, As and Sb Acta Crystallographica Section B 53(5) (1997) 773-779
Space group: I -4
Cell volume: 3628.3
Cell parameters: 16.272; 16.272; 13.703; 90; 90; 90;  

COD ID: 2101917
CIF file

Original IUCr paper

Formula: - C1.7 H5.54 Br0.14 N2 O -
Comments: Yeo, L.; Harris, K. D. M. Definitive Structural Characterization of the Conventional Low-Temperature Host Structure in Urea Inclusion Compounds Acta Crystallographica Section B 53(5) (1997) 822-830
Space group: P 61 2 2
Cell volume: 656.6
Cell parameters: 8.271; 8.271; 11.083; 90; 90; 120;  

COD ID: 2101918
CIF file

Original IUCr paper

Formula: - C2.08 H6.16 Br0.18 N2 O -
Comments: Yeo, L.; Harris, K. D. M. Definitive Structural Characterization of the Conventional Low-Temperature Host Structure in Urea Inclusion Compounds Acta Crystallographica Section B 53(5) (1997) 822-830
Space group: P 61 2 2
Cell volume: 645.69
Cell parameters: 8.2201; 8.2201; 11.0342; 90; 90; 120;  

COD ID: 2101919
CIF file

Original IUCr paper

Formula: - C1.7 H5.54 Br0.14 N2 O -
Comments: Yeo, L.; Harris, K. D. M. Definitive Structural Characterization of the Conventional Low-Temperature Host Structure in Urea Inclusion Compounds Acta Crystallographica Section B 53(5) (1997) 822-830
Space group: P 21 21 21
Cell volume: 1240.2
Cell parameters: 11.007; 13.945; 8.08; 90; 90; 90;  

COD ID: 2101920
CIF file

Original IUCr paper

Formula: - C2.08 H6.16 Br0.18 N2 O -
Comments: Yeo, L.; Harris, K. D. M. Definitive Structural Characterization of the Conventional Low-Temperature Host Structure in Urea Inclusion Compounds Acta Crystallographica Section B 53(5) (1997) 822-830
Space group: P 21 21 21
Cell volume: 1264.5
Cell parameters: 10.93; 14.133; 8.186; 90; 90; 90;  

COD ID: 2101921
CIF file

Original IUCr paper

Formula: - C17 H12 O -
Comments: Steiner, T.; Mason, S. A.; Tamm, M. Neutron Diffraction Study of Aromatic Hydrogen Bonds: 5-Ethynyl-5<i>H</i>-dibenzo[<i>a</i>,<i>d</i>]cyclohepten-5-ol at 20K Acta Crystallographica Section B 53(5) (1997) 843-848
Space group: P 1 21/a 1
Cell volume: 1168.99
Cell parameters: 11.8097; 8.2776; 12.003; 90; 94.951; 90;  

COD ID: 2101922
CIF file

Original IUCr paper

Formula: - C47 H34 N4 O Ru S -
Comments: Bartczak, T. J.; Rachlewicz, K.; Latos-Grażynski, L. Crystal and Molecular Structure of Thiocarbonyl-ethoxo(tetraphenylporphyrinato)ruthenium(II), [Ru(TPP)(CS)(HOC~2~H~5~)]. A Case of Centrosymmetric‒Noncentrosymmetric Ambiguity Acta Crystallographica Section B 53(5) (1997) 767-772
Space group: P -1
Cell volume: 1891.6
Cell parameters: 10.607; 11.308; 17.699; 77.53; 73.17; 69.85;  

COD ID: 2101923
CIF file

Original IUCr paper

Formula: - O3 Ti Y -
Comments: Hester, J. R.; Tomimoto, K.; Noma, H.; Okamura, F. P.; Akimitsu, J. Electron Density in YTiO~3~ Acta Crystallographica Section B 53(5) (1997) 739-744
Space group: P n m a
Cell volume: 230.95
Cell parameters: 5.689; 7.6094; 5.335; 90; 90; 90;  

COD ID: 2101924
CIF file

Original IUCr paper

Formula: - O3 Ti Y -
Comments: Hester, J. R.; Tomimoto, K.; Noma, H.; Okamura, F. P.; Akimitsu, J. Electron Density in YTiO~3~ Acta Crystallographica Section B 53(5) (1997) 739-744
Space group: P n m a
Cell volume: 231.24
Cell parameters: 5.6901; 7.613; 5.3381; 90; 90; 90;  

COD ID: 2101925
CIF file

Original IUCr paper

Formula: - O3 Ti Y -
Comments: Hester, J. R.; Tomimoto, K.; Noma, H.; Okamura, F. P.; Akimitsu, J. Electron Density in YTiO~3~ Acta Crystallographica Section B 53(5) (1997) 739-744
Space group: P n m a
Cell volume: 229.5
Cell parameters: 5.69; 7.583; 5.318; 90; 90; 90;  

COD ID: 2101926
CIF file

Original IUCr paper

Formula: - Fe3 O4 -
Comments: Sasaki, S. Radial Distribution of Electron Density in Magnetite, Fe~3~O~4~ Acta Crystallographica Section B 53(5) (1997) 762-766
Space group: F d -3 m {origin @ -3 m}
Cell volume: 587.4
Cell parameters: 8.375; 8.375; 8.375; 90; 90; 90;  

COD ID: 2101927
CIF file

Original IUCr paper

Formula: - O6 Sb Ta Ti -
Comments: Ling, Christopher; Thompson, John G.; Schmid, Siegbert; Cookson, David; Withers, Ray L. Structure Refinements of the Layered Intergrowth Phases Sb^III^Sb^V <i>x^</i><i>A</i>~1{-~<i>x</i>}TiO~6~ (<i>x</i>≃0, <i>A</i> = Ta, Nb) Using Synchrotron X-ray Powder Diffraction Data Acta Crystallographica Section B 53(6) (1997) 861-869
Space group: C 1 2/c 1
Cell volume: 438.957
Cell parameters: 16.57244; 4.82608; 5.48949; 90; 91.1727; 90;  

COD ID: 2101928
CIF file

Original IUCr paper

Formula: - Nb O6 Sb Ti -
Comments: Ling, Christopher; Thompson, John G.; Schmid, Siegbert; Cookson, David; Withers, Ray L. Structure Refinements of the Layered Intergrowth Phases Sb^III^Sb^V <i>x^</i><i>A</i>~1{-~<i>x</i>}TiO~6~ (<i>x</i>≃0, <i>A</i> = Ta, Nb) Using Synchrotron X-ray Powder Diffraction Data Acta Crystallographica Section B 53(6) (1997) 861-869
Space group: C 1 2/c 1
Cell volume: 440.11
Cell parameters: 16.6009; 4.82702; 5.4933; 90; 91.1159; 90;  

COD ID: 2101929
CIF file

Original IUCr paper

Formula: - C21 H21 N5 O11 -
Comments: Zaderenko, Paula; Gil, Ma. Soledad; López, Pilar; Ballesteros, Paloma; Fonseca, Isabel; Albert, Armando Diethyl 2-Benzimidazol-1-ylsuccinate‒Picric Acid (1/1) ‒ An Inclusion Molecular Complex Acta Crystallographica Section B 53(6) (1997) 961-967
Space group: P n a 21
Cell volume: 2480.9
Cell parameters: 11.31; 23.183; 9.462; 90; 90; 90;  

COD ID: 2101930
CIF file

Original IUCr paper

Formula: - O2 Ru -
Comments: Haines, J.; Léger, J. M.; Schulte, O.; Hull, S. Neutron Diffraction Study of the Ambient-Pressure, Rutile-Type and the High-Pressure, CaCl~2~-Type Phases of Ruthenium Dioxide Acta Crystallographica Section B 53(6) (1997) 880-884
Space group: P 42/m n m
Cell volume: 62.711
Cell parameters: 4.49307; 4.49307; 3.10639; 90; 90; 90;  

COD ID: 2101931
CIF file

Original IUCr paper

Formula: - O2 Ru -
Comments: Haines, J.; Léger, J. M.; Schulte, O.; Hull, S. Neutron Diffraction Study of the Ambient-Pressure, Rutile-Type and the High-Pressure, CaCl~2~-Type Phases of Ruthenium Dioxide Acta Crystallographica Section B 53(6) (1997) 880-884
Space group: P n n m
Cell volume: 61.547
Cell parameters: 4.4865; 4.4347; 3.0934; 90; 90; 90;  

COD ID: 2101932
CIF file

Original IUCr paper

Formula: - C10 H10 Fe -
Comments: Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B 53(6) (1997) 928-938
Space group: P 1 21/a 1
Cell volume: 395
Cell parameters: 10.443; 7.572; 5.824; 90; 120.95; 90;  

COD ID: 2101933
CIF file

Original IUCr paper

Formula: - C10 H10 Fe -
Comments: Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B 53(6) (1997) 928-938
Space group: P 1 21/a 1
Cell volume: 406.2
Cell parameters: 10.53; 7.604; 5.921; 90; 121.05; 90;  

COD ID: 2101934
CIF file

Original IUCr paper

Formula: - C10 H10 Fe -
Comments: Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B 53(6) (1997) 928-938
Space group: P 1 21/a 1
Cell volume: 395
Cell parameters: 10.443; 7.572; 5.824; 90; 120.95; 90;  

COD ID: 2101935
CIF file

Original IUCr paper

Formula: - C10 H10 Fe -
Comments: Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B 53(6) (1997) 928-938
Space group: P 1 21/a 1
Cell volume: 406.2
Cell parameters: 10.53; 7.604; 5.921; 90; 121.05; 90;  

COD ID: 2101936
CIF file

Original IUCr paper

Formula: - C10 H10 Fe -
Comments: Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B 53(6) (1997) 928-938
Space group: P 1 21/a 1
Cell volume: 395
Cell parameters: 10.443; 7.572; 5.824; 90; 120.95; 90;  

COD ID: 2101937
CIF file

Original IUCr paper

Formula: - C10 H10 Fe -
Comments: Brock, C. P.; Fu, Y. Rigid-Body Disorder Models for the High-Temperature Phase of Ferrocene Acta Crystallographica Section B 53(6) (1997) 928-938
Space group: P 1 21/a 1
Cell volume: 406.2
Cell parameters: 10.53; 7.604; 5.921; 90; 121.05; 90;  

COD ID: 2101938
CIF file

Original IUCr paper

Formula: - C19 H22 N2 O4 -
Comments: Verdonk, M. L.; Voogd, J. W.; Kanters, J. A.; Kroon, J.; den Besten, R.; Brandsma, L.; Leysen, D.; Kelder, J. Structure and Serotonin 5-HT~2C~ Receptor Activity of <i>ortho</i>- and <i>meta</i>-Substituted Phenylpiperazines Acta Crystallographica Section B 53(6) (1997) 976-983
Space group: P 1 21/a 1
Cell volume: 1747
Cell parameters: 10.8834; 11.2355; 14.743; 90; 104.295; 90;  

COD ID: 2101939
CIF file

Original IUCr paper

Formula: - C15 H20 N2 O5 -
Comments: Verdonk, M. L.; Voogd, J. W.; Kanters, J. A.; Kroon, J.; den Besten, R.; Brandsma, L.; Leysen, D.; Kelder, J. Structure and Serotonin 5-HT~2C~ Receptor Activity of <i>ortho</i>- and <i>meta</i>-Substituted Phenylpiperazines Acta Crystallographica Section B 53(6) (1997) 976-983
Space group: P 1 21/c 1
Cell volume: 1577.1
Cell parameters: 6.5086; 9.0954; 26.686; 90; 93.325; 90;  

COD ID: 2101940
CIF file

Original IUCr paper

Formula: - C17 H19 N5 O8 -
Comments: Verdonk, M. L.; Voogd, J. W.; Kanters, J. A.; Kroon, J.; den Besten, R.; Brandsma, L.; Leysen, D.; Kelder, J. Structure and Serotonin 5-HT~2C~ Receptor Activity of <i>ortho</i>- and <i>meta</i>-Substituted Phenylpiperazines Acta Crystallographica Section B 53(6) (1997) 976-983
Space group: P -1
Cell volume: 973.11
Cell parameters: 9.4085; 9.87; 10.9433; 77.563; 81.341; 81.08;  

COD ID: 2101941
CIF file

Original IUCr paper

Formula: - C16 H19 F3 N2 O4 -
Comments: Verdonk, M. L.; Voogd, J. W.; Kanters, J. A.; Kroon, J.; den Besten, R.; Brandsma, L.; Leysen, D.; Kelder, J. Structure and Serotonin 5-HT~2C~ Receptor Activity of <i>ortho</i>- and <i>meta</i>-Substituted Phenylpiperazines Acta Crystallographica Section B 53(6) (1997) 976-983
Space group: P 1 21/c 1
Cell volume: 1707.3
Cell parameters: 15.91; 6.0477; 18.66; 90; 108.028; 90;  

COD ID: 2101942
CIF file

Original IUCr paper

Formula: - Cl5 Mo -
Comments: Beck, J.; Wolf, F. Three New Polymorphic Forms of Molybdenum Pentachloride Acta Crystallographica Section B 53(6) (1997) 895-903
Space group: P -1
Cell volume: 303.7
Cell parameters: 6.716; 9.048; 6.074; 89.19; 118.17; 108.85;  

COD ID: 2101943
CIF file

HKL data

Original IUCr paper

Formula: - Cl5 Mo -
Comments: Beck, J.; Wolf, F. Three New Polymorphic Forms of Molybdenum Pentachloride Acta Crystallographica Section B 53(6) (1997) 895-903
Space group: P n m a
Cell volume: 1272.5
Cell parameters: 11.7; 17.874; 6.085; 90; 90; 90;  

COD ID: 2101944
CIF file

HKL data

Original IUCr paper

Formula: - Cl10 Mo2 -
Comments: Beck, J.; Wolf, F. Three New Polymorphic Forms of Molybdenum Pentachloride Acta Crystallographica Section B 53(6) (1997) 895-903
Space group: P 1 21/c 1
Cell volume: 1280.2
Cell parameters: 9.4682; 11.7496; 12.1619; 90; 108.879; 90;  

COD ID: 2101945
CIF file

Original IUCr paper

Formula: - C15 H15 Cl2 N O3 -
Comments: Ciechanowicz-Rutkowska, M.; Lieberman, H. F.; Hursthouse, M. B.; Scott, K. R. Crystallographic and Molecular Mechanics Study of Imidooxy Anticonvulsants Acta Crystallographica Section B 53(6) (1997) 945-952
Space group: P 1 21/c 1
Cell volume: 1572.3
Cell parameters: 13.238; 12.995; 9.309; 90; 100.938; 90;  

COD ID: 2101946
CIF file

Original IUCr paper

Formula: - C15 H16 Br N O3 -
Comments: Ciechanowicz-Rutkowska, M.; Lieberman, H. F.; Hursthouse, M. B.; Scott, K. R. Crystallographic and Molecular Mechanics Study of Imidooxy Anticonvulsants Acta Crystallographica Section B 53(6) (1997) 945-952
Space group: C 1 2/c 1
Cell volume: 2980.2
Cell parameters: 25.005; 12.7399; 9.3636; 90; 92.436; 90;  

COD ID: 2101947
CIF file

Original IUCr paper

Formula: - C16 H16 F3 N O3 -
Comments: Ciechanowicz-Rutkowska, M.; Lieberman, H. F.; Hursthouse, M. B.; Scott, K. R. Crystallographic and Molecular Mechanics Study of Imidooxy Anticonvulsants Acta Crystallographica Section B 53(6) (1997) 945-952
Space group: C 1 2/c 1
Cell volume: 3286.8
Cell parameters: 30.032; 12.0381; 9.099; 90; 92.362; 90;  

COD ID: 2101948
CIF file

Original IUCr paper

Formula: - C15 H16 Cl N O3 -
Comments: Ciechanowicz-Rutkowska, M.; Lieberman, H. F.; Hursthouse, M. B.; Scott, K. R. Crystallographic and Molecular Mechanics Study of Imidooxy Anticonvulsants Acta Crystallographica Section B 53(6) (1997) 945-952
Space group: P 1 21/c 1
Cell volume: 2968
Cell parameters: 9.055; 12.253; 26.855; 90; 95.16; 90;  

COD ID: 2101949
CIF file

Original IUCr paper

Formula: - C15 H16 Br N O3 -
Comments: Ciechanowicz-Rutkowska, M.; Lieberman, H. F.; Hursthouse, M. B.; Scott, K. R. Crystallographic and Molecular Mechanics Study of Imidooxy Anticonvulsants Acta Crystallographica Section B 53(6) (1997) 945-952
Space group: P 1 21/c 1
Cell volume: 3026.4
Cell parameters: 9.101; 12.274; 27.27; 90; 96.544; 90;  

COD ID: 2101950
CIF file

Original IUCr paper

Formula: - C16 H22 N6 -
Comments: Ochando, L. E.; Rius, J.; Louër, D.; Claramunt, R. M.; Lopez, C.; Elguero, J.; Amigó, J. M. Phase Transitions in Tris(3,5-dimethylpyrazol-1-yl)methane. The Structure of the High-Temperature Phase from X-ray Powder Diffraction Acta Crystallographica Section B 53(6) (1997) 939-944
Space group: P 3
Cell volume: 1209.4
Cell parameters: 16.152; 16.152; 5.353; 90; 90; 120;  

COD ID: 2101951
CIF file

Original IUCr paper

Formula: - Cl18 N4 P6 -
Comments: Belaj, F. Structure and Motion of Tetrakis(trichlorophosphazeno)phosphonium Hexachlorophosphate, [P(NPCl~3~)~4~]^+^PCl~6~^{-^}, at 93 K Acta Crystallographica Section B 53(6) (1997) 923-927
Space group: P 1 21/m 1
Cell volume: 1351.9
Cell parameters: 7.72; 21.235; 8.248; 90; 91.12; 90;  


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