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a
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siga
float64
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sigalpha
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sigbeta
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gamma
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siggamma
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float64
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celltemp
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sigcelltemp
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diffrtemp
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sigdiffrtemp
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sigcellpressure
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thermalhist
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nel
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sg
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commonname
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chemname
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mineral
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formula
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calcformula
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cellformula
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Z
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acce_code
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authors
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title
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journal
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year
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volume
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float64
radType
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Rall
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Robs
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float64
wRobs
float64
wRref
float64
RFsqd
float64
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float64
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1,008,024
5.509
0.001
7.008
0.002
12.256
0.002
95.1
0.02
95.17
0.01
109.25
0.02
441.3
null
null
null
null
null
null
null
null
null
2
A -1
-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)
2
Vanadium oxide (4/7)
- O7 V4 -
- O7 V4 -
- O28 V16 -
4
null
Hodeau, J L; Marezio, M
The crystal structure of V~4~ O~7~ at 120K
Journal of Solid State Chemistry
1,978
23
253
263
10.1016/0022-4596(78)90072-5
null
0.023
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hodeau, J L; Marezio, M The crystal structure of V~4~ O~7~ at 120K Journal of Solid State Chemistry 23 (1978) 253-263
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008024.cif $ #-------------------------------------------------------------------...
1,008,025
5.503
0.001
6.997
0.002
12.256
0.002
94.86
0.02
95.17
0.01
109.39
0.01
440
null
null
null
null
null
null
null
null
null
2
A -1
-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)
2
Vanadium oxide (4/7) - low-temperature phase
- O7 V4 -
- O7 V4 -
- O28 V16 -
4
null
Hodeau, J L; Marezio, M
The crystal structure of V~4~ O~7~ at 120K
Journal of Solid State Chemistry
1,978
23
253
263
10.1016/0022-4596(78)90072-5
null
0.042
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hodeau, J L; Marezio, M The crystal structure of V~4~ O~7~ at 120K Journal of Solid State Chemistry 23 (1978) 253-263
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008025.cif $ #-------------------------------------------------------------------...
1,008,026
5.9522
0.0009
21.618
0.006
7.543
0.003
90
null
103.804
0.024
90
null
942.6
null
null
null
null
null
null
null
null
null
4
P 1 21/c 1
-P 2ybc
14
Sodium thiosulfate pentahydrate
- H10 Na2 O8 S2 -
- H10 Na2 O8 S2 -
- H40 Na8 O32 S8 -
4
1
Lisensky, G C; Levy, H A
Sodium thiosulfate pentahydrate: a redetermination by neutron diffraction
Acta Crystallographica B (24,1968-38,1982)
1,978
34
1975
1977
10.1107/S0567740878007116
null
0.087
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lisensky, G C; Levy, H A Sodium thiosulfate pentahydrate: a redetermination by neutron diffraction Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1975-1977
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008026.cif $ #-------------------------------------------------------------------...
7,015,587
14.3781
0.0017
14.4587
0.0016
16.071
0.002
115.317
0.01
102.619
0.016
105.415
0.013
2,691.7
0.8
113
2
113
2
null
null
null
null
7
P -1
-P 1
2
- C89 H87.5 Gd Mn6 N12.5 Na2 O30.5 -
- C89 H82 Gd Mn6 N12.5 Na2 O30.5 -
- C89 H82 Gd Mn6 N12.5 Na2 O30.5 -
1
0.5
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng
Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4155
4161
10.1039/c0dt01746a
0.71073
MoKα
0.063
0.058
null
null
0.169
0.1736
null
null
null
null
null
1.041
null
null
has coordinates,has disorder
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4155-4161
291,143
2024-04-09
8:48:20
#------------------------------------------------------------------------------ #$Date: 2024-04-09 11:47:00 +0300 (Tue, 09 Apr 2024) $ #$Revision: 291143 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015587.cif $ #-------------------------------------------------------------------...
1,008,027
23.03
0.01
11.882
0.004
8.732
0.004
90
null
90
null
90
null
2,389.4
null
null
null
null
null
null
null
null
null
5
F m 2 m
F -2 -2
42
Nickel tetrapotassium cyclo-triphosphate heptahydrate
- H14 K4 Ni O25 P6 -
- H14 K4 Ni O25 P6 -
- H56 K16 Ni4 O100 P24 -
4
0.25
Seethanen, D; Tordjman, I; Averbuch-Pouchot, M T
Structure cristalline du trimetaphosphate mixte de nickelpotassium heptahydrate, Ni K~4~ (P~3~ O~9~)~2~ (H~2~ O)~7~, et donnees cristallographiques de Co K~4~ (P~3~ O~9~)~2~ (H~2~ O)~7~
Acta Crystallographica B (24,1968-38,1982)
1,978
34
2387
2390
10.1107/S0567740878008298
null
0.043
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Seethanen, D; Tordjman, I; Averbuch-Pouchot, M T Structure cristalline du trimetaphosphate mixte de nickelpotassium heptahydrate, Ni K~4~ (P~3~ O~9~)~2~ (H~2~ O)~7~, et donnees cristallographiques de Co K~4~ (P~3~ O~9~)~2~ (H~2~ O)~7~ Acta Crystallographica B (24,1968-38,1982) 34 (1978) 2387-2390
301,771
2025-08-18
12:22:45
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008027.cif $ #-------------------------------------------------------------------...
1,008,028
6.7215
0.0002
10.908
0.0003
7.1316
0.0002
90
null
91.104
0.003
90
null
522.8
null
null
null
null
null
null
null
null
null
4
P 1 21/n 1
-P 2yn
14
Barium chloride dihydrate
- Ba Cl2 H4 O2 -
- Ba Cl2 H4 O2 -
- Ba4 Cl8 H16 O8 -
4
1
Padmanabhan, V M; Busing, W R; Levy, H A
Barium chloride dihydrate by neutron diffraction
Acta Crystallographica B (24,1968-38,1982)
1,978
34
2290
2292
10.1107/S056774087800792X
null
0.046
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Padmanabhan, V M; Busing, W R; Levy, H A Barium chloride dihydrate by neutron diffraction Acta Crystallographica B (24,1968-38,1982) 34 (1978) 2290-2292
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008028.cif $ #-------------------------------------------------------------------...
1,008,029
10.97
0.02
10.97
0.02
10.97
0.02
90
null
90
null
90
null
1,320.1
null
null
null
null
null
null
null
null
null
5
F m -3
-F 2 2 3
202
Dicaesium lead hexanitrocuprate - $-alpha
- Cs2 Cu N6 O12 Pb -
- Cs2 Cu N6 O12 Pb -
- Cs8 Cu4 N24 O48 Pb4 -
4
0.041667
Klein, S; Reinen, D
The structure of the high temperature $-alpha modification of Cs~2~ Pb Cu (N O~2~)~6~ and the Jahn-Teller induced $-alpha $-beta phase transition - a neutron diffraction study
Journal of Solid State Chemistry
1,978
25
295
299
10.1016/0022-4596(78)90114-7
null
0.041
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Klein, S; Reinen, D The structure of the high temperature $-alpha modification of Cs~2~ Pb Cu (N O~2~)~6~ and the Jahn-Teller induced $-alpha $-beta phase transition - a neutron diffraction study Journal of Solid State Chemistry 25 (1978) 295-299
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008029.cif $ #-------------------------------------------------------------------...
1,008,030
9.695
0.003
6.906
0.003
7.522
0.003
90
null
94.75
0.05
90
null
501.9
null
null
null
null
null
null
null
null
null
3
P 1 21/n 1
-P 2yn
14
Barium catena-phosphate - γ
- Ba O6 P2 -
- Ba O6 P2 -
- Ba4 O24 P8 -
4
1
Coing-Boyat, J.; Averbuch-Pouchot, M. T.; Guitel, J. C.
Structure cristalline du polyphosphate de Baryum γ: Ba(PO~3~)~2~γ
Acta Crystallographica B (24,1968-38,1982)
1,978
34
9
2689
2692
10.1107/S0567740878009024
null
0.033
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Coing-Boyat, J.; Averbuch-Pouchot, M. T.; Guitel, J. C. Structure cristalline du polyphosphate de Baryum γ: Ba(PO~3~)~2~γ Acta Crystallographica B (24,1968-38,1982) 34(9) (1978) 2689-2692
189,453
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-12-27 16:53:58 +0200 (Tue, 27 Dec 2016) $ #$Revision: 189453 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008030.cif $ #-------------------------------------------------------------------...
1,008,031
7.184
0.001
6.79
0.001
7.256
0.001
94.68
0.01
104.97
0.01
88.77
0.01
340.8
null
null
null
null
null
null
null
null
null
4
P -1
-P 1
2
Strontium hydrogenphosphate - α
- H O4 P Sr -
- H0.5 O4 P Sr -
- H2 O16 P4 Sr4 -
4
2
Boudjada, A; Masse, R; Guitel, J C
Structure cristalline de l'orthophosphate monoacide de strontium: SrHPO~4~α: forme triclinique
Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry
1,978
34
9
2692
2695
10.1107/S0567740878009036
null
0.036
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Boudjada, A; Masse, R; Guitel, J C Structure cristalline de l'orthophosphate monoacide de strontium: SrHPO~4~α: forme triclinique Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry 34(9) (1978) 2692-2695
200,141
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-03 18:56:57 +0300 (Sun, 03 Sep 2017) $ #$Revision: 200141 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008031.cif $ #-------------------------------------------------------------------...
7,015,586
14.262
0.003
14.454
0.003
15.964
0.003
115.13
0.03
102.17
0.03
105.48
0.03
2,665.8
1.6
113
2
113
2
null
null
null
null
7
P -1
-P 1
2
- C89 H87.5 Mn6 N12.5 Na2 O30.5 Tb -
- C89 H82 Mn6 N12.5 Na2 O30.5 Tb -
- C89 H82 Mn6 N12.5 Na2 O30.5 Tb -
1
0.5
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng
Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4155
4161
10.1039/c0dt01746a
0.71073
MoKα
0.0977
0.0836
null
null
0.2316
0.2513
null
null
null
null
null
1.049
null
null
has coordinates,has disorder
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4155-4161
291,143
2024-04-09
8:48:12
#------------------------------------------------------------------------------ #$Date: 2024-04-09 11:47:00 +0300 (Tue, 09 Apr 2024) $ #$Revision: 291143 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015586.cif $ #-------------------------------------------------------------------...
1,008,032
14.02
null
9.49
0.01
9.57
0.01
90
null
93.12
0.01
90
null
1,271.4
null
null
null
null
null
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
Diammonium hydrogentris(chromato)arsenate
- As Cr3 H9 N2 O13 -
- As Cr3 H4.5 N2 O13 -
- As4 Cr12 H18 N8 O52 -
4
1
Averbuch-Pouchot, M T
Structure du tris(chromato)arsenate de diammonium-hydrogene, (N H~4~)~2~ H Cr~3~ As O~13~: mise en evidence d'un nouvel anion (Cr~3~ As O~13~)^3-^
Acta Crystallographica B (24,1968-38,1982)
1,978
34
3350
3351
10.1107/S0567740878010894
null
0.042
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Averbuch-Pouchot, M T Structure du tris(chromato)arsenate de diammonium-hydrogene, (N H~4~)~2~ H Cr~3~ As O~13~: mise en evidence d'un nouvel anion (Cr~3~ As O~13~)^3-^ Acta Crystallographica B (24,1968-38,1982) 34 (1978) 3350-3351
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008032.cif $ #-------------------------------------------------------------------...
1,008,033
5.11
0.01
10.3
null
6.15
0.01
90
null
90
null
90
null
323.7
null
null
null
null
null
null
null
null
null
3
P n n m
-P 2 2n
58
Cobalt uranium oxide (3/2/8)
- Co3 O8 U2 -
- Co3 O8 U2 -
- Co6 O16 U4 -
2
0.25
Bacmann, M
Structure cristalline du nouveau compose Co U~2~ O~8~
Acta Crystallographica B (24,1968-38,1982)
1,973
29
1570
1572
10.1107/S0567740873005066
null
0.122
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bacmann, M Structure cristalline du nouveau compose Co U~2~ O~8~ Acta Crystallographica B (24,1968-38,1982) 29 (1973) 1570-1572
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008033.cif $ #-------------------------------------------------------------------...
1,008,034
9.603
0.003
8.713
0.004
5.044
0.003
90
null
90
null
90
null
422
null
null
null
null
null
null
null
null
null
2
P n m a
-P 2ac 2n
62
Tungsten fluoride
- F6 W -
- F6 W -
- F24 W4 -
4
0.5
Levy, J H; Taylor, J C; Wilson, P W
The Structures of Fluorides XIII: The Orthorhombic Form of Tungsten Hexafluoride at 193K by Neutron Diffraction
Journal of Solid State Chemistry
1,975
15
360
365
10.1016/0022-4596(75)90292-3
null
0.075
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Levy, J H; Taylor, J C; Wilson, P W The Structures of Fluorides XIII: The Orthorhombic Form of Tungsten Hexafluoride at 193K by Neutron Diffraction Journal of Solid State Chemistry 15 (1975) 360-365
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008034.cif $ #-------------------------------------------------------------------...
1,008,035
7.942
0.002
7.942
0.002
4.441
0.002
90
null
90
null
120
null
242.6
null
null
null
null
null
null
null
null
null
2
P 63/m
-P 6c
176
Uranium(III) bromide
- Br3 U -
- Br3 U -
- Br6 U2 -
2
0.166667
Levy, J H; Taylor, J C; Wilson, P W
The structure of uranium tribromide by neutron diffraction profile analysis
Journal of the Less-Common Metals
1,975
39
265
270
10.1016/0022-5088(75)90200-3
null
0.1
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Levy, J H; Taylor, J C; Wilson, P W The structure of uranium tribromide by neutron diffraction profile analysis Journal of the Less-Common Metals 39 (1975) 265-270
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008035.cif $ #-------------------------------------------------------------------...
1,008,036
4.6964
0.0009
5.8287
0.001
4.8736
0.0007
91.63
0.01
92.44
0.01
82.79
0.01
132.2
null
null
null
null
null
null
null
null
null
3
P -1
-P 1
2
COPPER TUNGSTATE
- Cu O4 W -
- Cu O4 W -
- Cu2 O8 W2 -
2
1
Klein, S; Weitzel, H
Pernod - ein Programm zur Verfeinerung von Kristall-Strukturparametern aus Neutronenbeugungspulverdiagrammen
Journal of Applied Crystallography
1,975
8
54
59
10.1107/S0021889875009521
null
0.059
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Klein, S; Weitzel, H Pernod - ein Programm zur Verfeinerung von Kristall-Strukturparametern aus Neutronenbeugungspulverdiagrammen Journal of Applied Crystallography 8 (1975) 54-59
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008036.cif $ #-------------------------------------------------------------------...
7,015,585
14.43
0.003
14.485
0.003
16.11
0.003
115.34
0.03
102.79
0.03
105.25
0.03
2,712.3
1.7
113
2
113
2
null
null
null
null
7
P -1
-P 1
2
- C89 H87.5 Dy Mn6 N12.5 Na2 O30.5 -
- C89 H82 Dy Mn6 N12.5 Na2 O30.5 -
- C89 H82 Dy Mn6 N12.5 Na2 O30.5 -
1
0.5
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng
Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4155
4161
10.1039/c0dt01746a
0.71073
MoKα
0.0627
0.056
null
null
0.1597
0.1676
null
null
null
null
null
1.049
null
null
has coordinates,has disorder
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4155-4161
291,143
2024-04-09
8:48:04
#------------------------------------------------------------------------------ #$Date: 2024-04-09 11:47:00 +0300 (Tue, 09 Apr 2024) $ #$Revision: 291143 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015585.cif $ #-------------------------------------------------------------------...
1,008,037
9.432
0.008
8.907
0.006
5.22
0.005
72.67
0.01
78.33
0.01
76.09
0.01
402.3
null
null
null
null
null
null
null
null
null
heating at 353 K
5
P -1
-P 1
2
Potassium dizinc hydrogenbis(phosphate) - prepared by heating at 353 K
- H K O8 P2 Zn2 -
- H0.5 K O8 P2 Zn2 -
- H K2 O16 P4 Zn4 -
2
1
Averbuch-Pouchot, M T
Structure du monophosphate acide de potassium-zinc. K Zn~2~ H (P O~4~)~2~
Acta Crystallographica B (24,1968-38,1982)
1,979
35
1452
1454
10.1107/S0567740879006695
null
0.046
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Averbuch-Pouchot, M T Structure du monophosphate acide de potassium-zinc. K Zn~2~ H (P O~4~)~2~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1452-1454
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008037.cif $ #-------------------------------------------------------------------...
1,008,038
8.707
0.002
7.872
0.003
5.939
0.001
86.354
0.006
110.335
null
112.241
0.006
352.2
null
null
null
null
null
null
null
null
null
4
P -1
-P 1
2
Strontium bis(dihydrogenarsenate)
- As2 H4 O8 Sr -
- As2 H2 O8 Sr -
- As4 H4 O16 Sr2 -
2
1
Boudjada, A
Structure cristalline du monoarseniate diacide de strontium Sr (H~2~ As O~4~)~2~
Acta Crystallographica B (24,1968-38,1982)
1,979
35
1050
1052
10.1107/S0567740879005550
null
0.024
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Boudjada, A Structure cristalline du monoarseniate diacide de strontium Sr (H~2~ As O~4~)~2~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 1050-1052
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008038.cif $ #-------------------------------------------------------------------...
1,008,039
7.433
0.003
7.96
0.004
8.038
0.004
115.91
0.05
99.41
0.05
89.31
0.05
421.1
null
null
null
null
null
null
null
null
null
5
P -1
-P 1
2
Barium hydrogenarsenatodichromate
- As Ba Cr2 H O10 -
- As Ba Cr2 H2.5 O10 -
- As2 Ba2 Cr4 H5 O20 -
2
1
Blum, D; Averbuch-Pouchot, M T; Guitel, J C
Un nouvel exemple d'anion du type (X Cr~2~ O~10~) (X=As). Structure de Ba H (As Cr~2~ O~10~)
Acta Crystallographica B (24,1968-38,1982)
1,979
35
726
727
10.1107/S0567740879004556
null
0.045
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Blum, D; Averbuch-Pouchot, M T; Guitel, J C Un nouvel exemple d'anion du type (X Cr~2~ O~10~) (X=As). Structure de Ba H (As Cr~2~ O~10~) Acta Crystallographica B (24,1968-38,1982) 35 (1979) 726-727
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008039.cif $ #-------------------------------------------------------------------...
1,008,040
7.618
0.003
17.791
0.008
7.354
0.003
90
null
99.2
0.05
90
null
983.9
null
null
null
null
null
null
null
null
null
3
P 1 21/n 1
-P 2yn
14
Dipotassium trichromate
- Cr3 K2 O10 -
- Cr3 K2 O10 -
- Cr12 K8 O40 -
4
1
Blum, D; Averbuch-Pouchot, M T; Guitel, J C
Structure du tripolychromate de potassium K~2~ Cr~3~ O~10~
Acta Crystallographica B (24,1968-38,1982)
1,979
35
454
456
10.1107/S0567740879003769
null
0.049
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Blum, D; Averbuch-Pouchot, M T; Guitel, J C Structure du tripolychromate de potassium K~2~ Cr~3~ O~10~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 454-456
301,771
2025-08-18
12:22:45
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008040.cif $ #-------------------------------------------------------------------...
1,008,041
14.08
null
14.08
null
10.12
null
90
null
90
null
120
null
1,737.5
null
null
null
null
null
null
null
null
null
3
P 31 1 2
P 31 2 (0 0 4)
151
Potassium erbium fluoride
- Er F4 K -
18
3
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T
Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine
Annales de Chimie (Paris) (Vol=Year)
1,978
1,978
417
427
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine Annales de Chimie (Paris) (Vol=Year) 1978 (1978) 417-427
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008041.cif $ #-------------------------------------------------------------------...
1,008,042
11.51
null
11.51
null
11.51
null
90
null
90
null
90
null
1,524.8
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium triyttrium fluoride
- F10 K Y3 -
8
0.041667
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T
Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine
Annales de Chimie (Paris) (Vol=Year)
1,978
1,978
417
427
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine Annales de Chimie (Paris) (Vol=Year) 1978 (1978) 417-427
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008042.cif $ #-------------------------------------------------------------------...
7,015,584
14.365
0.002
14.473
0.002
16.09
0.003
115.254
0.013
102.58
0.02
105.467
0.017
2,696.7
1.1
113
2
113
2
null
null
null
null
7
P -1
-P 1
2
- C89 H87.5 Eu Mn6 N12.5 Na2 O30.5 -
- C89 H82 Eu Mn6 N12.5 Na2 O30.5 -
- C89 H82 Eu Mn6 N12.5 Na2 O30.5 -
1
0.5
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng
Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4155
4161
10.1039/c0dt01746a
0.71073
MoKα
0.0747
0.0661
null
null
0.1853
0.1923
null
null
null
null
null
1.066
null
null
has coordinates,has disorder
Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4155-4161
291,143
2024-04-09
8:47:55
#------------------------------------------------------------------------------ #$Date: 2024-04-09 11:47:00 +0300 (Tue, 09 Apr 2024) $ #$Revision: 291143 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015584.cif $ #-------------------------------------------------------------------...
1,008,043
8.07
null
8.07
null
13.2
null
90
null
90
null
120
null
744.5
null
null
null
null
null
null
null
null
null
3
P 63 m c
P 6c -2c
186
Potassium triytterbium fluoride - $-beta
- F10 K Yb3 -
4
0.333333
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T
Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine
Annales de Chimie (Paris) (Vol=Year)
1,978
1,978
417
427
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine Annales de Chimie (Paris) (Vol=Year) 1978 (1978) 417-427
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008043.cif $ #-------------------------------------------------------------------...
1,008,044
14.08
null
8.137
null
28.28
null
90
null
109.45
null
90
null
3,055.1
null
null
null
null
null
null
null
null
null
3
C 1 m 1
C -2y
8
Potassium trierbium fluoride - $-beta
- Er3 F10 K -
16
4
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T
Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine
Annales de Chimie (Paris) (Vol=Year)
1,978
1,978
417
427
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine Annales de Chimie (Paris) (Vol=Year) 1978 (1978) 417-427
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008044.cif $ #-------------------------------------------------------------------...
1,008,045
20.9
null
8.2
null
20.9
null
90
null
109.5
null
90
null
3,376.4
null
null
null
null
null
null
null
null
null
3
null
Potassium trithulium fluoride - $-beta
- F10 K Tm3 -
18
null
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T
Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine
Annales de Chimie (Paris) (Vol=Year)
1,978
1,978
417
427
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine Annales de Chimie (Paris) (Vol=Year) 1978 (1978) 417-427
35,911
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2012-02-28 14:14:52 +0200 (Tue, 28 Feb 2012) $ #$Revision: 35911 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008045.cif $ #--------------------------------------------------------------------...
1,008,046
5.92
0.02
10.334
0.03
4.75
0.02
90
null
90
null
91.07
null
290.5
null
null
null
null
null
null
null
null
null
3
P 1 1 21/b
-P 2bc
14
Cobalt phosphate
- Co3 O8 P2 -
- Co3 O8 P2 -
- Co6 O16 P4 -
2
0.5
Berthet, G; Joubert, J C; Bertaut, E F
Vacancies ordering in new metastable orthophosphates (Co~3~ ) P~2~ O~8~ and (Mg~3~ ) P~2~ O~8~ with olivin-related structure
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,972
136
98
105
null
0.1
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Berthet, G; Joubert, J C; Bertaut, E F Vacancies ordering in new metastable orthophosphates (Co~3~ ) P~2~ O~8~ and (Mg~3~ ) P~2~ O~8~ with olivin-related structure Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 136 (1972) 98-105
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008046.cif $ #-------------------------------------------------------------------...
7,015,583
6.41819
0.00012
23.1984
0.0004
10.39421
0.00017
90
null
94.3353
0.0016
90
null
1,543.18
0.05
173
null
173
null
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
- C24 H36 Au2 N2 P2 S4 -
- C24 H36 Au2 N2 P2 S4 -
- C48 H72 Au4 N4 P4 S8 -
2
0.5
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T
Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands.
Dalton transactions (Cambridge, England : 2003)
2,011
40
22
5852
5864
10.1039/c0dt01745k
0.71073
MoKα
0.029
0.0184
null
null
0.0332
0.034
null
null
null
null
null
0.919
null
null
has coordinates,has disorder
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands. Dalton transactions (Cambridge, England : 2003) 40(22) (2011) 5852-5864
179,859
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:42:55 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179859 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015583.cif $ #-------------------------------------------------------------------...
1,008,047
4.891
0.001
9.553
0.002
8.786
0.002
90
null
90
null
90
null
410.5
null
null
null
null
null
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
Iron vanadium oxide hydroxide *
- Fe H0.5 O6 V2 -
- Fe H0.5 O6 V2 -
- Fe4 H2 O24 V8 -
4
1
Muller, J; Joubert, J C; Marezio, M
Synthese et structure cristalline d'un nouvel oxyde mixte Fe V~2~ O~6~ H~0.5~. Relation avec la structure type Diaspore
Journal of Solid State Chemistry
1,979
27
367
382
10.1016/0022-4596(79)90179-8
null
0.024
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, J; Joubert, J C; Marezio, M Synthese et structure cristalline d'un nouvel oxyde mixte Fe V~2~ O~6~ H~0.5~. Relation avec la structure type Diaspore Journal of Solid State Chemistry 27 (1979) 367-382
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008047.cif $ #-------------------------------------------------------------------...
1,008,048
5.5942
0.0006
7.1216
0.0008
12.46
0.001
95.05
0.01
95.19
0.01
108.76
0.01
464.5
null
null
null
null
null
null
null
null
null
2
A -1
-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)
2
Heptaoxotetratitanate
- O7 Ti4 -
- O7 Ti4 -
- O28 Ti16 -
4
null
Hodeau, J L; Marezio, M
Structural aspects of the metal-insulator transition in (Ti~0.9975~ V~0.0025~)~4~ O~7~
Journal of Solid State Chemistry
1,979
29
47
62
10.1016/0022-4596(79)90208-1
null
0.025
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hodeau, J L; Marezio, M Structural aspects of the metal-insulator transition in (Ti~0.9975~ V~0.0025~)~4~ O~7~ Journal of Solid State Chemistry 29 (1979) 47-62
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008048.cif $ #-------------------------------------------------------------------...
1,008,049
5.5943
0.0005
7.1297
0.0007
12.484
0.001
95
0.01
95.426
0.009
109.023
0.009
464.9
null
null
null
null
null
null
null
null
null
2
A -1
-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)
2
Heptaoxotetratitanate
- O7 Ti4 -
- O7 Ti4 -
- O28 Ti16 -
4
null
Hodeau, J L; Marezio, M
Structural aspects of the metal-insulator transition in (Ti~0.9975~ V~0.0025~)~4~ O~7~
Journal of Solid State Chemistry
1,979
29
47
62
10.1016/0022-4596(79)90208-1
null
0.031
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hodeau, J L; Marezio, M Structural aspects of the metal-insulator transition in (Ti~0.9975~ V~0.0025~)~4~ O~7~ Journal of Solid State Chemistry 29 (1979) 47-62
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008049.cif $ #-------------------------------------------------------------------...
1,008,050
5.6235
0.0003
7.1984
0.0004
12.4018
0.0005
95.056
0.002
95.55
0.005
109.676
0.005
466.6
null
null
null
null
null
null
null
null
null
2
A -1
-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)
2
Heptaoxotetratitanate
- O7 Ti4 -
- O7 Ti4 -
- O28 Ti16 -
4
null
Hodeau, J L; Marezio, M
Structural aspects of the metal-insulator transition in (Ti~0.9975~ V~0.0025~)~4~ O~7~
Journal of Solid State Chemistry
1,979
29
47
62
10.1016/0022-4596(79)90208-1
null
0.022
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hodeau, J L; Marezio, M Structural aspects of the metal-insulator transition in (Ti~0.9975~ V~0.0025~)~4~ O~7~ Journal of Solid State Chemistry 29 (1979) 47-62
130,149
2020-10-21
18:00:00
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1,008,051
9.4907
0.0002
9.4907
0.0002
9.4907
0.0002
90
null
90
null
90
null
854.9
null
null
null
null
null
null
null
null
null
4
P n -3 :2
-P 2ab 2bc 3
201
Tribismuth gallium oxide diantimonate
- Bi3 Ga O11 Sb2 -
- Bi3 Ga0.9999 O11 Sb2.0001 -
- Bi12 Ga3.9996 O44 Sb8.0004 -
4
0.166667
Sleight, A W; Bouchard, R J
A new cubic K Sb O~3~ derivative structure with interpenetrating networks. Crystal structure of Bi~3~ Ga Sb~2~ O~11~
Inorganic Chemistry
1,973
12
2314
2316
10.1021/ic50128a019
null
0.051
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Sleight, A W; Bouchard, R J A new cubic K Sb O~3~ derivative structure with interpenetrating networks. Crystal structure of Bi~3~ Ga Sb~2~ O~11~ Inorganic Chemistry 12 (1973) 2314-2316
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008051.cif $ #-------------------------------------------------------------------...
7,015,582
9.0346
0.0003
12.1805
0.0003
14.0257
0.0004
93.738
0.002
105.979
0.003
102.402
0.003
1,436.45
0.08
173
null
173
null
null
null
null
null
8
P -1
-P 1
2
- C57 H55 Au2 Cl4 N2 O0.5 P2 S4 -
- C57 H54.5 Au2 Cl4 N2 O0.5 P2 S4 -
- C57 H54.5 Au2 Cl4 N2 O0.5 P2 S4 -
1
0.5
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T
Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands.
Dalton transactions (Cambridge, England : 2003)
2,011
40
22
5852
5864
10.1039/c0dt01745k
0.71073
MoKα
0.0497
0.0344
null
null
0.0816
0.0833
null
null
null
null
null
1.03
null
null
has coordinates,has disorder
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands. Dalton transactions (Cambridge, England : 2003) 40(22) (2011) 5852-5864
176,453
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $ #$Revision: 176453 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015582.cif $ #-------------------------------------------------------------------...
1,008,052
7.1321
0.0002
15.0468
0.0003
14.1771
0.0004
90
null
99.05
0.003
90
null
1,502.5
null
null
null
null
null
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
Trimercury bis(tetrachloroaluminate)
- Al2 Cl8 Hg3 -
- Al2 Cl8 Hg3 -
- Al8 Cl32 Hg12 -
4
1
Ellison, R D; Levy, H A; Fung, K W
Crystal and molecular structure of trimercury chloroaluminate, Hg~3~ (Al Cl~4~)~2~
Inorganic Chemistry
1,972
11
833
836
10.1021/ic50110a036
null
0.082
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ellison, R D; Levy, H A; Fung, K W Crystal and molecular structure of trimercury chloroaluminate, Hg~3~ (Al Cl~4~)~2~ Inorganic Chemistry 11 (1972) 833-836
130,149
2020-10-21
18:00:00
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1,008,053
3.885
null
3.885
null
12.784
null
90
null
90
null
90
null
193
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Lanthanum strontium iron(III) oxide
- Fe La O4 Sr -
- Fe La O4 Sr -
- Fe2 La2 O8 Sr2 -
2
0.0625
Soubeyroux, J L; Courbin, P; Fournes, L; Fruchart, D; le Flem, G
La phase Sr La Fe O~4~: Structures cristalline et magnetique
Journal of Solid State Chemistry
1,980
31
313
320
10.1016/0022-4596(80)90093-6
null
0.018
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Courbin, P; Fournes, L; Fruchart, D; le Flem, G La phase Sr La Fe O~4~: Structures cristalline et magnetique Journal of Solid State Chemistry 31 (1980) 313-320
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008053.cif $ #-------------------------------------------------------------------...
1,008,054
3.878
null
3.878
null
12.723
null
90
null
90
null
90
null
191.3
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Lanthanum strontium iron(III) oxide
- Fe La O4 Sr -
- Fe La O4 Sr -
- Fe2 La2 O8 Sr2 -
2
0.0625
Soubeyroux, J L; Courbin, P; Fournes, L; Fruchart, D; le Flem, G
La phase Sr La Fe O~4~: Structures cristalline et magnetique
Journal of Solid State Chemistry
1,980
31
313
320
10.1016/0022-4596(80)90093-6
null
0.018
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Courbin, P; Fournes, L; Fruchart, D; le Flem, G La phase Sr La Fe O~4~: Structures cristalline et magnetique Journal of Solid State Chemistry 31 (1980) 313-320
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008054.cif $ #-------------------------------------------------------------------...
1,008,055
11.844
null
11.844
null
11.844
null
90
null
90
null
90
null
1,661.5
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Rubidium trieuropium fluoride
- Eu3 F10 Rb -
- Eu3 F10 Rb -
- Eu24 F80 Rb8 -
8
0.041667
Arbus, A; Fournier, M T; Picaud, B; Boulon, G; Vedrine, A
Structure Cristalline du Compose Rb Eu~3~ F~10~
Journal of Solid State Chemistry
1,980
31
11
21
10.1016/0022-4596(80)90002-X
null
0.065
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Arbus, A; Fournier, M T; Picaud, B; Boulon, G; Vedrine, A Structure Cristalline du Compose Rb Eu~3~ F~10~ Journal of Solid State Chemistry 31 (1980) 11-21
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008055.cif $ #-------------------------------------------------------------------...
1,008,056
5.834
null
5.834
null
3.351
null
90
null
90
null
120
null
98.8
null
null
null
null
null
null
null
null
null
3
P -6 2 m
P -6 -2
189
Nickel cobalt phosphide (1/1/1)
- Co Ni P -
- Co Ni P -
- Co3 Ni3 P3 -
3
0.25
Senateur, J P; Rouault, A; L'Heritier, P; Krumbuegel-Nyland, A; Fruchart, R; Fruchart, D; Convert, P; Roudaut, E
La selectivite des substitutions dans les phases MM'P etude de l'ordre par diffraction neutronique dans Ni Co P
Materials Research Bulletin
1,973
8
229
238
10.1016/0025-5408(73)90176-1
null
0.015
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Senateur, J P; Rouault, A; L'Heritier, P; Krumbuegel-Nyland, A; Fruchart, R; Fruchart, D; Convert, P; Roudaut, E La selectivite des substitutions dans les phases MM'P etude de l'ordre par diffraction neutronique dans Ni Co P Materials Research Bulletin 8 (1973) 229-238
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008056.cif $ #-------------------------------------------------------------------...
7,015,581
13.822
0.0002
17.8518
0.0003
19.3592
0.0003
98.2051
0.0014
96.9952
0.0014
108.462
0.0017
4,413.11
0.13
173
null
173
null
null
null
null
null
10
P -1
-P 1
2
- C89 H82 Cl2 F12 Fe2 N2 O P6 Pd2 S4 -
- C89 H81 Cl2 F12 Fe2 N2 O P6 Pd2 S4 -
- C178 H162 Cl4 F24 Fe4 N4 O2 P12 Pd4 S8 -
2
1
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T
Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands.
Dalton transactions (Cambridge, England : 2003)
2,011
40
22
5852
5864
10.1039/c0dt01745k
0.71073
MoKα
0.0621
0.0379
null
null
0.1024
0.1072
null
null
null
null
null
0.974
null
null
has coordinates,has disorder
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands. Dalton transactions (Cambridge, England : 2003) 40(22) (2011) 5852-5864
179,859
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:42:55 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179859 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015581.cif $ #-------------------------------------------------------------------...
1,008,057
5.407
0.001
5.407
0.001
7.703
0.003
90
null
90
null
120
null
195
null
null
null
null
null
null
null
null
null
4
P -3 1 m
-P 3 2
162
Barium calcium tetrairon(III) oxide
- Ba Ca Fe4 O8 -
- Ba Ca Fe4 O8 -
- Ba Ca Fe4 O8 -
1
0.083333
Herrmann, D; Bacmann, M
Structure nucleaire de Ba Ca Fe~4~ O~8~
Materials Research Bulletin
1,971
6
725
736
10.1016/0025-5408(71)90106-1
null
0.033
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Herrmann, D; Bacmann, M Structure nucleaire de Ba Ca Fe~4~ O~8~ Materials Research Bulletin 6 (1971) 725-736
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008057.cif $ #-------------------------------------------------------------------...
1,008,058
6.2821
0.0007
3.6491
0.0004
10.844
0.001
90
null
92.24
0.01
90
null
248.4
null
null
null
null
null
null
null
null
null
3
I 1 2/m 1
-I 2y
12
Nickel dirhodium(III) selenide
- Ni Rh2 Se4 -
- Ni Rh2 Se4 -
- Ni2 Rh4 Se8 -
2
0.25
Bouchard, R J
The crystal structure and transport properties of Ni Rh~2~ Se~4~
Inorganic Chemistry
1,969
8
850
856
10.1021/ic50074a030
null
0.053
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bouchard, R J The crystal structure and transport properties of Ni Rh~2~ Se~4~ Inorganic Chemistry 8 (1969) 850-856
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008058.cif $ #-------------------------------------------------------------------...
1,008,059
7.911
0.002
7.861
0.001
18.092
0.003
90
null
90
null
90
null
1,125.1
null
null
null
null
null
null
null
null
null
5
P b c a
-P 2ac 2ab
61
Potassium antimony trifluoride nitrate
- F3 K N O3 Sb -
- F3 K N O3 Sb -
- F24 K8 N8 O24 Sb8 -
8
1
Bourgault, M; Ducourant, M B; Mascherpa Corral, D; Fourcade, R
Structure cristalline et moleculaire de K Sb F~3~ N O~3~
Journal of Fluorine Chemistry
1,981
17
215
224
10.1016/S0022-1139(00)81284-1
null
0.044
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bourgault, M; Ducourant, M B; Mascherpa Corral, D; Fourcade, R Structure cristalline et moleculaire de K Sb F~3~ N O~3~ Journal of Fluorine Chemistry 17 (1981) 215-224
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008059.cif $ #-------------------------------------------------------------------...
1,008,060
12.57
null
12.57
null
12.57
null
90
null
90
null
90
null
1,986.1
null
null
null
null
null
null
null
null
null
4
I a -3 d
-I 4bd 2c 3
230
Dialuminium tricalcium hydroxide
- Al2 Ca3 H12 O12 -
- Al2 Ca3 H12 O12 -
- Al16 Ca24 H96 O96 -
8
0.083333
Cohen-Addad, C; Ducros, P; Bertaut, E F
Etude de la substitution du groupement Si O~4~ par (O H)~4~ dans les composes Al~2~ Ca~3~ (O H)~12~ et Al~2~ Ca~3~ (Si O~4~)~2.16~ (O H)~3.36~ de type grenat
Acta Crystallographica (1,1948-23,1967)
1,967
23
220
230
10.1107/S0365110X67002518
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Cohen-Addad, C; Ducros, P; Bertaut, E F Etude de la substitution du groupement Si O~4~ par (O H)~4~ dans les composes Al~2~ Ca~3~ (O H)~12~ et Al~2~ Ca~3~ (Si O~4~)~2.16~ (O H)~3.36~ de type grenat Acta Crystallographica (1,1948-23,1967) 23 (1967) 220-230
301,771
2025-08-18
12:22:45
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008060.cif $ #-------------------------------------------------------------------...
1,008,061
11.935
0.004
14.287
0.004
11.732
0.004
90
null
97.23
0.02
90
null
1,984.6
null
null
null
null
null
null
null
null
null
4
C 1 2/m 1
-C 2y
12
14-Carbonyltrio-dimanganeseiron
- C14 Fe Mn2 O14 -
- C14 Fe Mn2 O14 -
- C56 Fe4 Mn8 O56 -
4
0.5
Agron, P A; Ellison, R D; Levy, H A
The crystal structure of dimanganese iron carbonyl, Mn~2~ Fe (C O)~14~
Acta Crystallographica (1,1948-23,1967)
1,967
23
1079
1086
10.1107/S0365110X67004281
null
0.0247
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Agron, P A; Ellison, R D; Levy, H A The crystal structure of dimanganese iron carbonyl, Mn~2~ Fe (C O)~14~ Acta Crystallographica (1,1948-23,1967) 23 (1967) 1079-1086
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008061.cif $ #-------------------------------------------------------------------...
1,008,062
6.7283
0.0005
6.7283
null
5.6263
0.0005
90
null
90
null
120
null
220.6
null
null
null
null
null
null
null
null
null
3
P 63/m m c
-P 6c 2c
194
Barium vanadium(IV) sulfide
- Ba S3 V -
- Ba S3 V -
- Ba2 S6 V2 -
2
0.083333
Ghedira, M; Chenavas, J; Sayetat, F; Marezio, M; Massenet, O; Mercier, J
Structural aspects of the hexagonal to orthorhombic transition in stoichiometric Ba V S~3~
Acta Crystallographica B (24,1968-38,1982)
1,981
37
1491
1496
10.1107/S0567740881006420
null
0.011
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ghedira, M; Chenavas, J; Sayetat, F; Marezio, M; Massenet, O; Mercier, J Structural aspects of the hexagonal to orthorhombic transition in stoichiometric Ba V S~3~ Acta Crystallographica B (24,1968-38,1982) 37 (1981) 1491-1496
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008062.cif $ #-------------------------------------------------------------------...
7,015,580
13.5263
0.0002
17.6262
0.0003
19.4449
0.0004
96.8975
0.0015
97.5228
0.0015
107.783
0.0015
4,313.12
0.14
173
null
173
null
null
null
null
null
9
P -1
-P 1
2
- C87 H76 Cl2 F12 Fe2 N2 Ni2 P6 S4 -
- C87.001 H76.002 Cl2.002 F12 Fe2 N2 Ni2 P6 S4 -
- C174.002 H152.004 Cl4.004 F24 Fe4 N4 Ni4 P12 S8 -
2
1
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T
Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands.
Dalton transactions (Cambridge, England : 2003)
2,011
40
22
5852
5864
10.1039/c0dt01745k
1.54184
CuKα
0.0467
0.0409
null
null
0.1135
0.1168
null
null
null
null
null
1.105
null
null
has coordinates,has disorder
Oliver, Katie; White, Andrew J. P.; Hogarth, Graeme; Wilton-Ely, James D E T Multimetallic complexes of group 10 and 11 metals based on polydentate dithiocarbamate ligands. Dalton transactions (Cambridge, England : 2003) 40(22) (2011) 5852-5864
179,859
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:42:55 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179859 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015580.cif $ #-------------------------------------------------------------------...
1,008,063
3.777
0.003
3.777
null
6.498
0.006
90
null
90
null
120
null
80.3
null
null
null
null
null
null
null
null
null
2
P -3 m 1
-P 3 2"
164
Titanium telluride
- Te2 Ti -
- Te2 Ti -
- Te2 Ti -
1
0.083333
Arnaud, Y; Chevreton, M
Etude comparative des composes Ti X~2~ (X= S, Se, Te). Structures de Ti Te~2~ et Ti Se Te
Journal of Solid State Chemistry
1,981
39
230
239
10.1016/0022-4596(81)90336-4
null
0.034
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Arnaud, Y; Chevreton, M Etude comparative des composes Ti X~2~ (X= S, Se, Te). Structures de Ti Te~2~ et Ti Se Te Journal of Solid State Chemistry 39 (1981) 230-239
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008063.cif $ #-------------------------------------------------------------------...
1,008,064
3.651
0.003
3.651
null
6.317
0.006
90
null
90
null
120
null
72.9
null
null
null
null
null
null
null
null
null
3
P -3 m 1
-P 3 2"
164
Titanium selenide telluride
- Se Te Ti -
- Se Te Ti -
- Se Te Ti -
1
0.083333
Arnaud, Y; Chevreton, M
Etude comparative des composes Ti X~2~ (X= S, Se, Te). Structures de Ti Te~2~ et Ti Se Te
Journal of Solid State Chemistry
1,981
39
230
239
10.1016/0022-4596(81)90336-4
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Arnaud, Y; Chevreton, M Etude comparative des composes Ti X~2~ (X= S, Se, Te). Structures de Ti Te~2~ et Ti Se Te Journal of Solid State Chemistry 39 (1981) 230-239
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008064.cif $ #-------------------------------------------------------------------...
1,008,065
6.64
null
7.33
null
6.4
null
90
null
92.67
null
90
null
311.2
null
null
null
null
null
null
null
null
null
2
P 1 21/c 1
-P 2ybc
14
Xenon difluoride xenon tetrafluoride
- F6 Xe2 -
- F6 Xe2 -
- F12 Xe4 -
2
0.5
Burns, J H; Ellison, R D; Levy, H A
The crystal structure of the molecular addition compound xenon difluoride-xenon tetrafluoride
Journal of Physical Chemistry
1,963
67
1569
1570
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Burns, J H; Ellison, R D; Levy, H A The crystal structure of the molecular addition compound xenon difluoride-xenon tetrafluoride Journal of Physical Chemistry 67 (1963) 1569-1570
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008065.cif $ #-------------------------------------------------------------------...
1,008,066
4.888
null
11.937
null
5.11
null
90
null
90
null
90
null
298.2
null
null
null
null
null
null
null
null
null
3
P b c n
-P 2n 2ab
60
Uranium(VI) iron oxide
- Fe O4 U -
- Fe O4 U -
- Fe4 O16 U4 -
4
0.5
Bachmann, M; Bertaut, E F
Structure du nouveau compose U Fe O~4~
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,967
90
257
258
null
0.018
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bachmann, M; Bertaut, E F Structure du nouveau compose U Fe O~4~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 90 (1967) 257-258
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008066.cif $ #-------------------------------------------------------------------...
1,008,067
4.871
null
11.787
null
5.053
null
90
null
90
null
90
null
290.1
null
null
null
null
null
null
null
null
null
3
P b c n
-P 2n 2ab
60
Chromium uranium(V) oxide
- Cr O4 U -
- Cr O4 U -
- Cr4 O16 U4 -
4
0.5
Bacmann, M; Bertaut, E F
Structure de U Cr O~4~
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,964
87
275
276
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bacmann, M; Bertaut, E F Structure de U Cr O~4~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 87 (1964) 275-276
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008067.cif $ #-------------------------------------------------------------------...
1,008,068
5.805
0.002
5.805
null
7.556
null
90
null
90
null
120
null
220.5
null
null
null
null
null
null
null
null
null
4
P -3 m 1
-P 3 2"
164
Rubidium sodium tetrafluoroberyllate (1.5/.5/1)
- Be2 F8 Na Rb3 -
- Be2 F8 Na Rb3 -
- Be2 F8 Na Rb3 -
1
0.083333
Pontonnier, L; Caillet, M; Aleonard, S
Etude des systemes Me(I)~2~ Be F~4~ - Na~2~ Be F~4~
Materials Research Bulletin
1,972
7
799
812
10.1016/0025-5408(72)90130-4
null
0.09
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pontonnier, L; Caillet, M; Aleonard, S Etude des systemes Me(I)~2~ Be F~4~ - Na~2~ Be F~4~ Materials Research Bulletin 7 (1972) 799-812
282,761
2023-04-20
6:45:55
#------------------------------------------------------------------------------ #$Date: 2023-04-20 09:45:28 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282761 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008068.cif $ #-------------------------------------------------------------------...
7,015,579
27.7369
0.0019
28.1589
0.0019
30.573
0.002
90
null
90
null
90
null
23,879
3
100
2
100
2
null
null
null
null
6
C c c a :2
-C 2a 2ac
68
- C158 H341 Eu4 Fe16 N35 O104 -
- C158 H288 Eu4 Fe16 N35 O104 -
- C632 H1152 Eu16 Fe64 N140 O416 -
4
0.25
Baniodeh, Amer; Hewitt, Ian J.; Mereacre, Valeriu; Lan, Yanhua; Novitchi, Ghenadie; Anson, Christopher E.; Powell, Annie K.
Heterometallic 20-membered {Fe16Ln4} (Ln = Sm, Eu, Gd, Tb, Dy, Ho) metallo-ring aggregates.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4080
4086
10.1039/c0dt01742f
0.71073
MoKα
0.0628
0.0496
null
null
0.15
0.1586
null
null
null
null
null
1.201
null
null
has coordinates,has disorder
Baniodeh, Amer; Hewitt, Ian J.; Mereacre, Valeriu; Lan, Yanhua; Novitchi, Ghenadie; Anson, Christopher E.; Powell, Annie K. Heterometallic 20-membered {Fe16Ln4} (Ln = Sm, Eu, Gd, Tb, Dy, Ho) metallo-ring aggregates. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4080-4086
176,432
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015579.cif $ #-------------------------------------------------------------------...
1,008,069
4.871
null
11.787
null
5.053
null
90
null
90
null
90
null
290.1
null
null
null
null
null
null
null
null
null
3
P b c n
-P 2n 2ab
60
Chromium uranium(V) oxide
- Cr O4 U -
- Cr O4 U -
- Cr4 O16 U4 -
4
0.5
Bacmann, M; Bertaut, E F; Bassi, G
Parametres atomiques et structure magnetique de U Cr O~4~
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,965
88
214
218
null
0.1
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bacmann, M; Bertaut, E F; Bassi, G Parametres atomiques et structure magnetique de U Cr O~4~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 88 (1965) 214-218
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008069.cif $ #-------------------------------------------------------------------...
1,008,070
4.49
null
5.55
null
4.88
null
90
null
90
null
90
null
121.6
null
null
null
null
null
null
null
null
null
prepared at 70kbar and 1273K
prepared at 70kbar
3
P -1
-P 1
2
Iron vanadium oxide (.8/1.3/4) - prepared at 70kbar and 1273K
- Fe0.75 O4 V1.25 -
- Fe0.75 O4 V1.25 -
- Fe1.5 O8 V2.5 -
2
1
Muller, J; Joubert, J C; Marezio, M
Etude des phases du systeme Fe V O~4~ - V O~2~, obtenues par synthese hydrothermale a 70 kbar et 1273k
Journal of Solid State Chemistry
1,976
18
357
362
10.1016/0022-4596(76)90118-3
null
0.048
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, J; Joubert, J C; Marezio, M Etude des phases du systeme Fe V O~4~ - V O~2~, obtenues par synthese hydrothermale a 70 kbar et 1273k Journal of Solid State Chemistry 18 (1976) 357-362
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008070.cif $ #-------------------------------------------------------------------...
1,008,071
13.967
0.006
8.472
0.004
7.51
0.003
90
null
90.54
0.05
90
null
888.6
null
null
null
null
null
null
null
null
null
2
C 1 2/c 1
-C 2yc
15
Uranium(IV) iodide
- I4 U -
- I4 U -
- I16 U4 -
4
0.5
Levy, J H; Taylor, J C; Waugh, A B
Crystal Structure of Uranium(IV) Tetraiodide by X-ray and Neutron Diffraction
Inorganic Chemistry
1,980
19
672
674
10.1021/ic50205a019
null
0.129
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Levy, J H; Taylor, J C; Waugh, A B Crystal Structure of Uranium(IV) Tetraiodide by X-ray and Neutron Diffraction Inorganic Chemistry 19 (1980) 672-674
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008071.cif $ #-------------------------------------------------------------------...
1,008,072
5.947
0.001
3.504
0.002
6.726
0.002
90
null
90
null
90
null
140.2
null
null
null
null
null
null
null
null
null
3
P n m a
-P 2ac 2n
62
Cobalt manganese phosphide (1/1/1)
- Co Mn P -
- Co Mn P -
- Co4 Mn4 P4 -
4
0.5
Fruchart, D; Bacmann, M; Chaudouet, P
Structure du Phosphure de Cobalt et de Manganese
Acta Crystallographica B (24,1968-38,1982)
1,980
36
2759
2761
10.1107/S0567740880009910
null
0.033
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Fruchart, D; Bacmann, M; Chaudouet, P Structure du Phosphure de Cobalt et de Manganese Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2759-2761
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008072.cif $ #-------------------------------------------------------------------...
1,008,073
3.97
null
3.544
null
12.84
null
90
null
90
null
90
null
180.7
null
null
null
null
null
null
null
null
null
3
I m m m
-I 2 2
71
Distrontium palladium oxide
- O3 Pd Sr2 -
- O3 Pd Sr2 -
- O6 Pd2 Sr4 -
2
0.125
Muller, O; Roy, R
Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides
Advances in Chemistry Series
1,971
98
28
38
null
0.066
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; Roy, R Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides Advances in Chemistry Series 98 (1971) 28-38
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008073.cif $ #-------------------------------------------------------------------...
1,008,074
5.826
null
5.826
null
5.826
null
90
null
90
null
90
null
197.7
null
null
null
null
null
null
null
null
null
3
P m -3 n
-P 4n 2 3
223
Strontium tripalladium oxide
- O4 Pd3 Sr -
- O4 Pd3 Sr -
- O8 Pd6 Sr2 -
2
0.041667
Muller, O; Roy, R
Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides
Advances in Chemistry Series
1,971
98
28
38
null
0.058
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; Roy, R Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides Advances in Chemistry Series 98 (1971) 28-38
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008074.cif $ #-------------------------------------------------------------------...
1,008,075
5.747
null
5.747
null
5.747
null
90
null
90
null
90
null
189.8
null
null
null
null
null
null
null
null
null
3
P m -3 n
-P 4n 2 3
223
Calcium tripalladium oxide
- Ca O4 Pd3 -
- Ca O4 Pd3 -
- Ca2 O8 Pd6 -
2
0.041667
Muller, O; Roy, R
Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides
Advances in Chemistry Series
1,971
98
28
38
null
0.078
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; Roy, R Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides Advances in Chemistry Series 98 (1971) 28-38
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008075.cif $ #-------------------------------------------------------------------...
7,015,578
27.7714
0.0011
28.0818
0.0011
30.6492
0.0013
90
null
90
null
90
null
23,902.4
1.7
100
2
100
2
null
null
null
null
6
C c c a :2
-C 2a 2ac
68
- C156 H338 Dy4 Fe16 N34 O104 -
- C156 H288 Dy4 Fe16 N34 O104 -
- C624 H1152 Dy16 Fe64 N136 O416 -
4
0.25
Baniodeh, Amer; Hewitt, Ian J.; Mereacre, Valeriu; Lan, Yanhua; Novitchi, Ghenadie; Anson, Christopher E.; Powell, Annie K.
Heterometallic 20-membered {Fe16Ln4} (Ln = Sm, Eu, Gd, Tb, Dy, Ho) metallo-ring aggregates.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4080
4086
10.1039/c0dt01742f
0.71073
MoKα
0.0598
0.0508
null
null
0.1713
0.1858
null
null
null
null
null
1.115
null
null
has coordinates,has disorder
Baniodeh, Amer; Hewitt, Ian J.; Mereacre, Valeriu; Lan, Yanhua; Novitchi, Ghenadie; Anson, Christopher E.; Powell, Annie K. Heterometallic 20-membered {Fe16Ln4} (Ln = Sm, Eu, Gd, Tb, Dy, Ho) metallo-ring aggregates. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4080-4086
176,432
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015578.cif $ #-------------------------------------------------------------------...
1,008,076
5.742
null
5.742
null
5.742
null
90
null
90
null
90
null
189.3
null
null
null
null
null
null
null
null
null
3
P m -3 n
-P 4n 2 3
223
Cadmium tripalladium oxide
- Cd O4 Pd3 -
- Cd O4 Pd3 -
- Cd2 O8 Pd6 -
2
0.041667
Muller, O; Roy, R
Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides
Advances in Chemistry Series
1,971
98
28
38
null
0.084
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; Roy, R Synthesis and Crystal Chemistry of Some New Complex Palladium Oxides Advances in Chemistry Series 98 (1971) 28-38
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008076.cif $ #-------------------------------------------------------------------...
1,008,077
9.727
null
9.976
null
3.136
null
90
null
90
null
90
null
304.3
null
null
null
null
null
null
null
null
null
3
B b m m
-B 2 2b
63
Dititanium(III) calcium oxide
- Ca O4 Ti2 -
- Ca O4 Ti2 -
- Ca4 O16 Ti8 -
4
0.25
Bertaut, E F; Blum, P
Determination de la Structure de Ti~2~ Ca O~4~ par la Methode Self- Consistante d'Approche Directe
Acta Crystallographica (1,1948-23,1967)
1,956
9
121
126
10.1107/S0365110X56003132
null
0.16
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bertaut, E F; Blum, P Determination de la Structure de Ti~2~ Ca O~4~ par la Methode Self- Consistante d'Approche Directe Acta Crystallographica (1,1948-23,1967) 9 (1956) 121-126
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008077.cif $ #-------------------------------------------------------------------...
1,008,078
3.874
null
3.874
null
6.332
null
90
null
90
null
120
null
82.3
null
null
null
null
null
null
null
null
null
3
P -3
-P 3
147
Europium copper(I) sulfide (.7/2/2)
- Cu1.9998 Er0.6666 S1.9998 -
- Cu2 Er0.6667 S2 -
- Cu2 Er0.6667 S2 -
1
0.166667
Ballestracci, R; Bertaut, E F
Etude cristallographique de nouveaux sulfures de terres rares et de cuivre(I)
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,965
88
575
579
null
0.04
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ballestracci, R; Bertaut, E F Etude cristallographique de nouveaux sulfures de terres rares et de cuivre(I) Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 88 (1965) 575-579
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008078.cif $ #-------------------------------------------------------------------...
1,008,079
5.94
null
3.42
null
11.14
null
90
null
91.05
null
90
null
226.3
null
null
null
null
null
null
null
null
null
3
I 1 2/m 1
-I 2y
12
Dichromium nickel tetrasulfide
- Cr2 Ni S4 -
- Cr2 Ni S4 -
- Cr4 Ni2 S8 -
2
0.25
Andron, B; Bertaut, E F
Etude par Diffraction neutronique de Cr~2~ Ni S~4~
Journal de Physique (Paris)
1,966
27
619
626
10.1051/jphys:01966002709-10061900
null
0.08
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Andron, B; Bertaut, E F Etude par Diffraction neutronique de Cr~2~ Ni S~4~ Journal de Physique (Paris) 27 (1966) 619-626
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008079.cif $ #-------------------------------------------------------------------...
1,008,080
16.915
null
7.954
null
5.233
null
90
null
90
null
90
null
704.1
null
null
null
null
null
null
null
null
null
2
I b a m
-I 2 2c
72
Titanium germanium (6/5)
- Ge5 Ti6 -
- Ge5 Ti6 -
- Ge20 Ti24 -
4
0.25
Spinat, P; Fruchart, R
Structure des phase binaires V~6~ Si~5~ et Ti~6~ Ge~5~
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,970
93
23
36
null
0.082
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Spinat, P; Fruchart, R Structure des phase binaires V~6~ Si~5~ et Ti~6~ Ge~5~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 93 (1970) 23-36
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008080.cif $ #-------------------------------------------------------------------...
1,008,081
13.807
null
13.807
null
9.429
null
90
null
90
null
120
null
1,556.7
null
null
null
null
null
null
null
null
null
3
R -3 :H
-R 3
148
Heptasodium hexazirconium fluoride
- F31 Na7 Zr6 -
- F31 Na7 Zr6 -
- F93 Na21 Zr18 -
3
0.166667
Burns, J H; Ellison, R D; Levy, H A
The crystal structure of Na~7~ Zr~6~ F~31~
Acta Crystallographica B (24,1968-38,1982)
1,968
24
230
237
10.1107/S0567740868002013
null
0.027
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Burns, J H; Ellison, R D; Levy, H A The crystal structure of Na~7~ Zr~6~ F~31~ Acta Crystallographica B (24,1968-38,1982) 24 (1968) 230-237
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008081.cif $ #-------------------------------------------------------------------...
1,008,082
5.482
null
8.237
null
6.147
null
90
null
90
null
90
null
277.6
null
null
null
null
null
null
null
null
null
3
C m c m
-C 2c 2
63
NICKEL CHROMATE
- Cr Ni O4 -
- Cr Ni O4 -
- Cr4 Ni4 O16 -
4
0.25
Muller, O; White, W B; Roy, R
X-ray diffraction study of the chromates of nickel, magnesium and cadmium
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,969
130
112
120
null
0.112
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; White, W B; Roy, R X-ray diffraction study of the chromates of nickel, magnesium and cadmium Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 130 (1969) 112-120
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008082.cif $ #-------------------------------------------------------------------...
7,015,577
27.7908
0.0014
27.9903
0.0015
31.269
0.002
90
null
90
null
90
null
24,323
2
150
2
150
2
null
null
null
null
6
C c c a :2
-C 2a 2ac
68
- C156 H338 Fe16 Gd4 N34 O104 -
- C144 H288 Fe16 Gd4 N24 O80 -
- C576 H1152 Fe64 Gd16 N96 O320 -
4
0.25
Baniodeh, Amer; Hewitt, Ian J.; Mereacre, Valeriu; Lan, Yanhua; Novitchi, Ghenadie; Anson, Christopher E.; Powell, Annie K.
Heterometallic 20-membered {Fe16Ln4} (Ln = Sm, Eu, Gd, Tb, Dy, Ho) metallo-ring aggregates.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4080
4086
10.1039/c0dt01742f
0.71073
MoKα
0.0697
0.0505
null
null
0.1172
0.1212
null
null
null
null
null
0.991
null
null
has coordinates
Baniodeh, Amer; Hewitt, Ian J.; Mereacre, Valeriu; Lan, Yanhua; Novitchi, Ghenadie; Anson, Christopher E.; Powell, Annie K. Heterometallic 20-membered {Fe16Ln4} (Ln = Sm, Eu, Gd, Tb, Dy, Ho) metallo-ring aggregates. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4080-4086
176,432
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015577.cif $ #-------------------------------------------------------------------...
1,008,083
5.497
null
8.368
null
6.147
null
90
null
90
null
90
null
282.8
null
null
null
null
null
null
null
null
null
3
C m c m
-C 2c 2
63
Magnesium chromate - $-alpha
- Cr Mg O4 -
- Cr Mg O4 -
- Cr4 Mg4 O16 -
4
0.25
Muller, O; White, W B; Roy, R
X-ray diffraction study of the chromates of nickel, magnesium and cadmium
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,969
130
112
120
null
0.126
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; White, W B; Roy, R X-ray diffraction study of the chromates of nickel, magnesium and cadmium Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 130 (1969) 112-120
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008083.cif $ #-------------------------------------------------------------------...
1,008,084
5.678
null
8.723
null
6.926
null
90
null
90
null
90
null
343
null
null
null
null
null
null
null
null
null
3
C m c m
-C 2c 2
63
Cadmium chromate - $-alpha
- Cd Cr O4 -
- Cd Cr O4 -
- Cd4 Cr4 O16 -
4
0.25
Muller, O; White, W B; Roy, R
X-ray diffraction study of the chromates of nickel, magnesium and cadmium
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,969
130
112
120
null
0.209
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; White, W B; Roy, R X-ray diffraction study of the chromates of nickel, magnesium and cadmium Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 130 (1969) 112-120
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008084.cif $ #-------------------------------------------------------------------...
1,008,085
10.397
null
9.675
null
7.064
null
90
null
101.52
null
90
null
696.3
null
null
null
null
null
null
null
null
null
3
C 1 2/m 1
-C 2y
12
Cadmium chromate - $-beta
- Cd Cr O4 -
- Cd Cr O4 -
- Cd8 Cr8 O32 -
8
1
Muller, O; White, W B; Roy, R
X-ray diffraction study of the chromates of nickel, magnesium and cadmium
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,969
130
112
120
null
0.207
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; White, W B; Roy, R X-ray diffraction study of the chromates of nickel, magnesium and cadmium Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 130 (1969) 112-120
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008085.cif $ #-------------------------------------------------------------------...
1,008,086
9.95
null
9.16
null
6.759
null
90
null
103.68
null
90
null
598.6
null
null
null
null
null
null
null
null
null
3
C 1 2/m 1
-C 2y
12
Magnesium chromate - $-beta
- Cr Mg O4 -
- Cr Mg O4 -
- Cr8 Mg8 O32 -
8
1
Muller, O; White, W B; Roy, R
X-ray diffraction study of the chromates of nickel, magnesium and cadmium
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,969
130
112
120
null
0.157
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, O; White, W B; Roy, R X-ray diffraction study of the chromates of nickel, magnesium and cadmium Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 130 (1969) 112-120
301,771
2025-08-18
12:22:45
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008086.cif $ #-------------------------------------------------------------------...
1,008,087
6.64
0.01
7.33
0.01
6.4
0.01
90
null
92.67
0.08
90
null
311.2
null
null
null
null
null
null
null
null
null
2
P 1 21/c 1
-P 2ybc
14
Xenon(II) xenon(IV) fluoride
- F6 Xe2 -
- F6 Xe2 -
- F12 Xe4 -
2
0.5
Burns, J. H.; Ellison, R. D.; Levy, H. A.
The crystal structure of the molecular addition compound xenon difluoride - xenon tetrafluoride
Acta Crystallographica (1,1948-23,1967)
1,965
18
1
11
16
10.1107/S0365110X65000038
null
0.031
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Burns, J. H.; Ellison, R. D.; Levy, H. A. The crystal structure of the molecular addition compound xenon difluoride - xenon tetrafluoride Acta Crystallographica (1,1948-23,1967) 18(1) (1965) 11-16
282,478
2023-04-06
12:32:03
#------------------------------------------------------------------------------ #$Date: 2023-04-06 15:31:51 +0300 (Thu, 06 Apr 2023) $ #$Revision: 282478 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008087.cif $ #-------------------------------------------------------------------...
7,015,576
9.629
0.0003
11.788
0.0005
13.824
0.0005
99.918
0.002
105.773
0.002
96.22
0.001
1,467.4
0.1
150
2
150
2
null
null
null
null
7
P 1
P 1
1
- C23 H28 Cu F6 N4 O7 S2 -
- C23 H28 Cu F6 N4 O7 S2 -
- C46 H56 Cu2 F12 N8 O14 S4 -
2
2
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R.
When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3677
3682
10.1039/c0dt01740j
0.71073
MoKα
0.0438
0.0341
null
null
0.0774
0.083
null
null
null
null
null
1.042
null
null
has coordinates
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R. When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction. Dalton transactions (Cambridge, England : 2003)...
301,847
2025-08-21
11:39:34
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015576.cif $ #-------------------------------------------------------------------...
1,008,088
3.9335
null
3.9335
null
20.853
null
90
null
90
null
90
null
322.6
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
BARIUM DILANTHANUM DIIRON(III) OXIDE
- Ba Fe2 La2 O7 -
- Ba0.999 Fe2 La2.001 O7 -
- Ba1.998 Fe4 La4.002 O14 -
2
0.0625
Samaras, D; Collomb, A; Joubert, J C
Determination des structures de deux ferrite mixtes nouveaux de formule Ba La~2~ Fe~2~ O~7~ et Sr Tb~2~ Fe~2~ O~7~
Journal of Solid State Chemistry
1,973
7
337
348
10.1016/0022-4596(73)90142-4
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Samaras, D; Collomb, A; Joubert, J C Determination des structures de deux ferrite mixtes nouveaux de formule Ba La~2~ Fe~2~ O~7~ et Sr Tb~2~ Fe~2~ O~7~ Journal of Solid State Chemistry 7 (1973) 337-348
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008088.cif $ #-------------------------------------------------------------------...
1,008,089
5.227
0.003
5.227
0.003
8.802
0.004
90
null
90
null
120
null
208.3
null
null
null
null
null
null
null
null
null
3
P 63 2 2
P 6c 2c
182
BARIUM DIALUMINIUM OXIDE
- Al2 Ba O4 -
- Al2 Ba O4 -
- Al4 Ba2 O8 -
2
0.166667
Do Dinh, C; Bertaut, C
Parametres atomiques de Ba Al~2~ O~4~ et etudes des solutions solides Ba Fe~x~ Al~2-x~ O~4~ et Ba Ga~x~ Al~2-x~ O~4~
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,965
88
413
416
null
0.05
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Do Dinh, C; Bertaut, C Parametres atomiques de Ba Al~2~ O~4~ et etudes des solutions solides Ba Fe~x~ Al~2-x~ O~4~ et Ba Ga~x~ Al~2-x~ O~4~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 88 (1965) 413-416
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008089.cif $ #-------------------------------------------------------------------...
1,008,090
6.63
0.01
13.36
0.02
14.43
0.02
90
null
90
null
90
null
1,278.2
null
null
null
null
null
null
null
null
null
3
P n m a
-P 2ac 2n
62
Tris(dibromophosphazene)
- Br6 N3 P3 -
- Br6 N3 P3 -
- Br24 N12 P12 -
4
0.5
de Santis, P; Giglio, E; Ripamonti, A
The crystal structure of trimeric phosphonitrilic bromide.
Journal of Inorganic and Nuclear Chemistry
1,962
24
469
474
10.1016/0022-1902(62)80232-2
null
0.21
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
de Santis, P; Giglio, E; Ripamonti, A The crystal structure of trimeric phosphonitrilic bromide. Journal of Inorganic and Nuclear Chemistry 24 (1962) 469-474
301,771
2025-08-18
12:22:45
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:21:50 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301771 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008090.cif $ #-------------------------------------------------------------------...
1,008,091
5.326
null
5.602
null
7.635
null
90
null
90
null
90
null
227.8
null
null
null
null
null
null
null
null
null
3
P b n m
-P 2c 2ab
62
Terbium iron(III) oxide
- Fe O3 Tb -
- Fe O3 Tb -
- Fe4 O12 Tb4 -
4
0.5
Bertaut, E F; Chappert, J; Mareschal, J; Rebouillat, J P; Sivardiere, J
Structures magnetiques de Tb Fe O~3~
Solid State Communications
1,967
5
293
298
10.1016/0038-1098(67)90276-1
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bertaut, E F; Chappert, J; Mareschal, J; Rebouillat, J P; Sivardiere, J Structures magnetiques de Tb Fe O~3~ Solid State Communications 5 (1967) 293-298
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008091.cif $ #-------------------------------------------------------------------...
1,008,092
7.166
null
7.166
null
6.281
null
90
null
90
null
90
null
322.5
null
null
null
null
null
null
null
null
null
3
I 41/a m d :1
I 4bw 2bw -1bw
141
Terbium chromate(V)
- Cr O4 Tb -
- Cr O4 Tb -
- Cr4 O16 Tb4 -
4
0.125
Buisson, G; Tcheou, F; Sayetat, F; Scheunemann, K
Crystallographic and magnetic properties of Tb Cr O~4~ at low temperature (X-Ray and neutron experiments)
Solid State Communications
1,976
18
871
875
10.1016/0038-1098(76)90226-X
null
0.026
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Buisson, G; Tcheou, F; Sayetat, F; Scheunemann, K Crystallographic and magnetic properties of Tb Cr O~4~ at low temperature (X-Ray and neutron experiments) Solid State Communications 18 (1976) 871-875
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008092.cif $ #-------------------------------------------------------------------...
1,008,093
6.17
0.003
6.17
0.003
8.564
0.003
90
null
90
null
90
null
326
null
null
null
null
null
null
null
null
null
3
P 43 2 2
P 4cw 2c
95
Dimanganese titanium oxide
- Mn2 O4 Ti -
- Mn2 O4 Ti -
- Mn8 O16 Ti4 -
4
0.5
Bertaut, E F; Vincent, H
Etude par diffraction neutronique de la forme ordonnee de l' orthotitanate de manganese - structure cristalline et structure magnetique
Solid State Communications
1,968
6
269
275
10.1016/0038-1098(68)90102-6
null
0.08
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bertaut, E F; Vincent, H Etude par diffraction neutronique de la forme ordonnee de l' orthotitanate de manganese - structure cristalline et structure magnetique Solid State Communications 6 (1968) 269-275
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008093.cif $ #-------------------------------------------------------------------...
7,015,575
9.552
0.0002
27.025
0.001
10.151
0.0004
90
null
97.143
0.002
90
null
2,600.07
0.15
150
2
150
2
null
null
null
null
7
P 1 21 1
P 2yb
4
- C20 H24 Cu F6 N4 O6 S2 -
- C20 H24 Cu F6 N4 O6 S2 -
- C80 H96 Cu4 F24 N16 O24 S8 -
4
2
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R.
When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3677
3682
10.1039/c0dt01740j
0.71073
MoKα
0.0711
0.0462
null
null
0.0959
0.1061
null
null
null
null
null
1.039
null
null
has coordinates,has disorder
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R. When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction. Dalton transactions (Cambridge, England : 2003)...
301,847
2025-08-21
11:39:34
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015575.cif $ #-------------------------------------------------------------------...
1,008,094
7.734
0.003
15.531
0.006
21.376
0.008
90
null
90
null
90.1
0.01
2,567.6
null
null
null
null
null
null
null
null
null
5
B 1 1 2/b
-B 2b
15
Dicaesium lead hexanitrocuprate - γ
- Cs2 Cu N6 O12 Pb -
- Cs2 Cu N6 O12 Pb -
- Cs16 Cu8 N48 O96 Pb8 -
8
1
Klein, S.; Reinen, D.
The Structure of the Low-Temperature γ-Modification of Cs~2~PbCu(NO~2~)~6~: A Powder Neutron Diffraction Study at 160 K
Journal of Solid State Chemistry
1,980
32
311
319
10.1016/S0022-4596(80)80025-9
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Klein, S.; Reinen, D. The Structure of the Low-Temperature γ-Modification of Cs~2~PbCu(NO~2~)~6~: A Powder Neutron Diffraction Study at 160 K Journal of Solid State Chemistry 32 (1980) 311-319
189,454
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-12-27 16:57:15 +0200 (Tue, 27 Dec 2016) $ #$Revision: 189454 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008094.cif $ #-------------------------------------------------------------------...
1,008,095
5.939
0.002
5.939
0.002
5.939
0.002
90
null
90
null
90
null
209.5
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead fluoride - Bi-doped
- Bi0.05 F2.05 Pb0.95 -
- Bi0.05 F2.05 Pb0.95 -
- Bi0.2 F8.2 Pb3.8 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.0167
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008095.cif $ #-------------------------------------------------------------------...
1,008,096
5.932
0.002
5.932
0.002
5.932
0.002
90
null
90
null
90
null
208.7
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead bismuth fluoride (0.9/0.1/2.1)
- Bi0.1 F2.1 Pb0.9 -
- Bi0.1 F2.1008 Pb0.9 -
- Bi0.4 F8.4032 Pb3.6 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.0175
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008096.cif $ #-------------------------------------------------------------------...
1,008,097
5.926
0.002
5.926
0.002
5.926
0.002
90
null
90
null
90
null
208.1
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead bismuth fluoride (0.9/0.1/2.1)
- Bi0.15 F2.15 Pb0.85 -
- Bi0.15 F2.15 Pb0.85 -
- Bi0.6 F8.6 Pb3.4 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.018
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008097.cif $ #-------------------------------------------------------------------...
1,008,098
5.919
0.002
5.919
0.002
5.919
0.002
90
null
90
null
90
null
207.4
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead bismuth fluoride (0.8/0.2/2.2)
- Bi0.25 F2.25 Pb0.75 -
- Bi0.25 F2.2508 Pb0.75 -
- Bi F9.0032 Pb3 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.027
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008098.cif $ #-------------------------------------------------------------------...
7,015,574
8.859
0.0002
11.253
0.0003
14.779
0.0005
80.18
0.001
86.856
0.001
68.96
0.001
1,354.92
0.07
150
2
150
2
null
null
null
null
7
P 1
P 1
1
- C21 H24 Cu F6 N4 O7 S2 -
- C21 H24 Cu F6 N4 O7 S2 -
- C42 H48 Cu2 F12 N8 O14 S4 -
2
2
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R.
When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3677
3682
10.1039/c0dt01740j
0.71073
MoKα
0.049
0.0416
null
null
0.1024
0.108
null
null
null
null
null
1.023
null
null
has coordinates
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R. When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction. Dalton transactions (Cambridge, England : 2003)...
301,847
2025-08-21
11:39:34
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015574.cif $ #-------------------------------------------------------------------...
1,008,099
5.913
0.002
5.913
0.002
5.913
0.002
90
null
90
null
90
null
206.7
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead bismuth fluoride (0.7/0.3/2.3)
- Bi0.3 F2.3 Pb0.7 -
- Bi0.3 F2.3 Pb0.7 -
- Bi1.2 F9.2 Pb2.8 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.025
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/80/1008099.cif $ #-------------------------------------------------------------------...
1,008,100
5.905
0.002
5.905
0.002
5.905
0.002
90
null
90
null
90
null
205.9
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead bismuth fluoride (0.6/0.4/2.4)
- Bi0.4 F2.4 Pb0.6 -
- Bi0.4 F2.4 Pb0.6 -
- Bi1.6 F9.6 Pb2.4 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.0311
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008100.cif $ #-------------------------------------------------------------------...
1,008,101
5.894
0.002
5.894
0.002
5.894
0.002
90
null
90
null
90
null
204.8
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead bismuth fluoride (0.5/0.5/2.5)
- Bi0.5 F2.5 Pb0.5 -
- Bi0.5 F2.5004 Pb0.5 -
- Bi2 F10.0016 Pb2 -
4
0.020833
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique
Journal of Solid State Chemistry
1,980
32
279
287
10.1016/S0022-4596(80)80021-1
null
0.0495
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Lucat, C; Portier, J; Reau, J M; Hagenmueller, P; Soubeyroux, J L Etude par diffraction de neutrons de la solution solide Pb~1-x~ Bi~x~ F~2+x~: Correlations entre structure et conductivite ionique Journal of Solid State Chemistry 32 (1980) 279-287
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008101.cif $ #-------------------------------------------------------------------...
1,008,102
7.687
0.001
8.049
0.001
8.06
0.001
116.25
0.01
108.21
0.01
84.14
0.01
424.5
null
null
null
null
null
null
null
null
null
5
P -1
-P 1
2
Ammonium zinc trihydrogenbis(phosphate) hydrate
- H9 N O9 P2 Zn -
- H18.5 N O9 P2 Zn -
- H37 N2 O18 P4 Zn2 -
2
1
Boudjada, A; Tranqui, D; Guitel, J C
Structure d'un Orthophosphate Acide Mixte de Zinc Ammonium Monohydrate: Zn (N H~4~) H~3~ (P O~4~)~2~ (H~2~ O)
Acta Crystallographica B (24,1968-38,1982)
1,980
36
1176
1178
10.1107/S0567740880005511
null
0.024
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Boudjada, A; Tranqui, D; Guitel, J C Structure d'un Orthophosphate Acide Mixte de Zinc Ammonium Monohydrate: Zn (N H~4~) H~3~ (P O~4~)~2~ (H~2~ O) Acta Crystallographica B (24,1968-38,1982) 36 (1980) 1176-1178
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008102.cif $ #-------------------------------------------------------------------...
7,015,573
21.106
0.005
21.106
0.005
8.547
0.003
90
null
90
null
90
null
3,807.4
1.8
150
2
150
2
null
null
null
null
7
P 43 21 2
P 4nw 2abw
96
- C36 H40 Cu F6 N4 O8 S2 -
- C36 H40 Cu F6 N4 O8 S2 -
- C144 H160 Cu4 F24 N16 O32 S8 -
4
0.5
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R.
When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3677
3682
10.1039/c0dt01740j
0.6889
Synchrotron
0.0435
0.0413
null
null
0.094
0.0958
null
null
null
null
null
1.139
null
null
has coordinates,has disorder
Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R. When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction. Dalton transactions (Cambridge, England : 2003)...
301,847
2025-08-21
11:39:34
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/55/7015573.cif $ #-------------------------------------------------------------------...
1,008,103
6.7296
0.0006
10.2792
0.0007
5.1916
0.0005
100.26
0.01
113.73
0.01
71.94
0.01
312
null
null
null
null
null
null
null
null
null
4
P -1
-P 1
2
Lithium yttrium molybdate
- Li Mo2 O8 Y -
- Li Mo2 O8 Y -
- Li2 Mo4 O16 Y2 -
2
1
le Page, Y; Strobel, P
Structure of Lithium Yttrium Bismolybdate(VI)
Acta Crystallographica B (24,1968-38,1982)
1,980
36
1919
1920
10.1107/S0567740880007467
null
0.06
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
le Page, Y; Strobel, P Structure of Lithium Yttrium Bismolybdate(VI) Acta Crystallographica B (24,1968-38,1982) 36 (1980) 1919-1920
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008103.cif $ #-------------------------------------------------------------------...
1,008,104
5.524
null
8.308
null
6.234
null
90
null
90
null
90
null
286.1
null
null
null
null
null
null
null
null
null
3
C m c m
-C 2c 2
63
Cobalt chromate
- Co Cr O4 -
- Co Cr O4 -
- Co4 Cr4 O16 -
4
0.25
Pernet, M; Quezel, G; Coing-Boyat, J; Bertaut, E F
Structures magnetiques des chromates de cobalt et de nickel
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,969
92
264
273
null
0.057
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pernet, M; Quezel, G; Coing-Boyat, J; Bertaut, E F Structures magnetiques des chromates de cobalt et de nickel Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 92 (1969) 264-273
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008104.cif $ #-------------------------------------------------------------------...
1,008,105
5.484
null
8.22
null
6.127
null
90
null
90
null
90
null
276.2
null
null
null
null
null
null
null
null
null
3
C m c m
-C 2c 2
63
Nickel chromate
- Cr Ni O4 -
- Cr Ni O4 -
- Cr4 Ni4 O16 -
4
0.25
Pernet, M; Quezel, G; Coing-Boyat, J; Bertaut, E F
Structures magnetiques des chromates de cobalt et de nickel
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,969
92
264
273
null
0.11
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pernet, M; Quezel, G; Coing-Boyat, J; Bertaut, E F Structures magnetiques des chromates de cobalt et de nickel Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 92 (1969) 264-273
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008105.cif $ #-------------------------------------------------------------------...
1,008,106
10.198
null
8.035
null
7.63
null
90
null
90
null
90
null
625.2
null
null
null
null
null
null
null
null
null
4
C m c 21
C 2c -2
36
Molybdenum manganese silicide carbide (1/4/1/1)
- C Mn4 Mo Si -
- C Mn4 Mo Si -
- C8 Mn32 Mo8 Si8 -
8
1
Spinat, P; Fruchart, R; Kabbani, M; Herpin, P
Structure de Mn~5~ Si C
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,970
93
171
184
null
0.1
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Spinat, P; Fruchart, R; Kabbani, M; Herpin, P Structure de Mn~5~ Si C Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 93 (1970) 171-184
208,902
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-07 04:59:37 +0300 (Sat, 07 Jul 2018) $ #$Revision: 208902 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008106.cif $ #-------------------------------------------------------------------...
1,008,107
10.198
null
8.035
null
7.63
null
90
null
90
null
90
null
625.2
null
null
null
null
null
null
null
null
null
3
C m c 21
C 2c -2
36
Manganese silicide carbide (5/1/1)
- C Mn5 Si -
- C Mn5 Si -
- C8 Mn40 Si8 -
8
1
Spinat, P; Fruchart, R; Kabbani, M; Herpin, P
Structure de Mn~5~ Si C
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,970
93
171
184
null
0.063
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Spinat, P; Fruchart, R; Kabbani, M; Herpin, P Structure de Mn~5~ Si C Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 93 (1970) 171-184
208,902
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-07 04:59:37 +0300 (Sat, 07 Jul 2018) $ #$Revision: 208902 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/81/1008107.cif $ #-------------------------------------------------------------------...
1,008,108
11.297
null
12.993
null
7.839
null
90
null
101.5
null
90
null
1,127.5
null
null
null
null
null
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
Diammonium manganese catena-phosphate
- H8 Mn N2 O12 P4 -
- H8 Mn N2 O12 P4 -
- H32 Mn4 N8 O48 P16 -
4
1
Duc Tran Qui; Tordjman, I; Averbuch, M T; Bassi, G
Structure cristalline du polyphosphate de manganese-ammonium
Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)
1,970
93
413
420
null
0.1
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Duc Tran Qui; Tordjman, I; Averbuch, M T; Bassi, G Structure cristalline du polyphosphate de manganese-ammonium Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 93 (1970) 413-420
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