file
int64
a
float64
siga
float64
b
float64
sigb
float64
c
float64
sigc
float64
alpha
float64
sigalpha
float64
beta
float64
sigbeta
float64
gamma
float64
siggamma
float64
vol
float64
sigvol
float64
celltemp
float64
sigcelltemp
float64
diffrtemp
float64
sigdiffrtemp
float64
cellpressure
float64
sigcellpressure
float64
diffrpressure
float64
sigdiffrpressure
float64
thermalhist
string
pressurehist
string
compoundsource
string
nel
string
sg
string
sgHall
string
sgNumber
int64
commonname
string
chemname
string
mineral
string
formula
string
calcformula
string
cellformula
string
Z
int64
Zprime
float64
acce_code
string
authors
string
title
string
journal
string
year
int64
volume
int64
issue
string
firstpage
string
lastpage
string
doi
string
method
string
radiation
string
wavelength
float64
radType
string
radSymbol
string
Rall
float64
Robs
float64
Rref
float64
wRall
float64
wRobs
float64
wRref
float64
RFsqd
float64
RI
float64
gofall
float64
gofobs
float64
gofgt
float64
gofref
float64
duplicateof
int64
optimal
int64
status
string
flags
string
text
string
svnrevision
int64
date
string
time
string
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string
cif_text
string
1,008,608
12.799
null
12.799
null
12.799
null
90
null
90
null
90
null
2,096.7
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Manganese yttrium deuteride (23/6/18)
- D18 Mn23 Y6 -
- D18 Mn23 Y6 -
- D72 Mn92 Y24 -
4
0.020833
Commandre, M; Fruchart, D; Rouault, A; Sauvage, D; Shoemaker, C B; Shoemaker, D P
Etude par diffraction neutronique des composes Mn~23~ Y~6~ D~x~
Journal de Physique (Paris)
1,979
40
L639
L642
null
0.05
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Commandre, M; Fruchart, D; Rouault, A; Sauvage, D; Shoemaker, C B; Shoemaker, D P Etude par diffraction neutronique des composes Mn~23~ Y~6~ D~x~ Journal de Physique (Paris) 40 (1979) L639-L642
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/1/00/86/1008608.cif $ #-------------------------------------------------------------------...
1,008,609
12.84
null
12.84
null
12.84
null
90
null
90
null
90
null
2,116.9
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Manganese yttrium deuteride (23/6/23)
- D23 Mn23 Y6 -
- D22.92 Mn23 Y6 -
- D91.68 Mn92 Y24 -
4
0.020833
Commandre, M; Fruchart, D; Rouault, A; Sauvage, D; Shoemaker, C B; Shoemaker, D P
Etude par diffraction neutronique des composes Mn~23~ Y~6~ D~x~
Journal de Physique (Paris)
1,979
40
L639
L642
null
0.048
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Commandre, M; Fruchart, D; Rouault, A; Sauvage, D; Shoemaker, C B; Shoemaker, D P Etude par diffraction neutronique des composes Mn~23~ Y~6~ D~x~ Journal de Physique (Paris) 40 (1979) L639-L642
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/1/00/86/1008609.cif $ #-------------------------------------------------------------------...
1,008,610
5.9454
0.0003
5.9454
0.0003
5.9454
0.0003
90
null
90
null
90
null
210.2
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.98/.03/2.05)
- F2.05 Pb0.975 Th0.025 -
- F2.04 Pb0.975 Th0.025 -
- F8.16 Pb3.9 Th0.1 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.02
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008610.cif $ #-------------------------------------------------------------------...
1,008,611
5.9465
0.0003
5.9465
0.0003
5.9465
0.0003
90
null
90
null
90
null
210.3
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.95/.05/2.1)
- F2.1 Pb0.95 Th0.05 -
- F2.08 Pb0.95 Th0.05 -
- F8.32 Pb3.8 Th0.2 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.017
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008611.cif $ #-------------------------------------------------------------------...
7,015,471
12.17
0.0008
16.4977
0.0011
20.0795
0.0012
94.498
0.001
93.493
0.001
106.921
0.001
3,830.2
0.4
153
2
153
2
null
null
null
null
5
P -1
-P 1
2
- C80 H70 Co3 N20 O11 -
- C80 H50 Co3 N20 O11 -
- C160 H100 Co6 N40 O22 -
2
1
Li, Bo; Zhang, Jingping; Yong, Xue; Li, Wenliang; Zheng, Yiying
The low spin Co(II) fragment with homoleptic 1,10-phenanthroline ligands: synthesis, structures, DFT investigations, and magnetic properties.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4459
4464
10.1039/c0dt01640c
0.71073
MoKα
0.1304
0.0676
null
null
0.1396
0.1588
null
null
null
null
null
0.978
null
null
has coordinates
Li, Bo; Zhang, Jingping; Yong, Xue; Li, Wenliang; Zheng, Yiying The low spin Co(II) fragment with homoleptic 1,10-phenanthroline ligands: synthesis, structures, DFT investigations, and magnetic properties. Dalton transactions (Cambridge, England : 2003) 40(17) (2011) 4459-4464
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015471.cif $ #-------------------------------------------------------------------...
1,008,612
5.9528
0.0003
5.9528
0.0003
5.9528
0.0003
90
null
90
null
90
null
210.9
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.9/.1/2.2)
- F2.2 Pb0.9 Th0.1 -
- F2.18 Pb0.9 Th0.1 -
- F8.72 Pb3.6 Th0.4 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.022
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008612.cif $ #-------------------------------------------------------------------...
1,008,613
5.957
0.0003
5.957
0.0003
5.957
0.0003
90
null
90
null
90
null
211.4
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.88/.13/2.25)
- F2.25 Pb0.875 Th0.125 -
- F2.256 Pb0.875 Th0.125 -
- F9.024 Pb3.5 Th0.5 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.019
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008613.cif $ #-------------------------------------------------------------------...
1,008,614
5.9581
0.0003
5.9581
0.0003
5.9581
0.0003
90
null
90
null
90
null
211.5
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.85/.15/2.3)
- F2.3 Pb0.85 Th0.15 -
- F2.28 Pb0.85 Th0.15 -
- F9.12 Pb3.4 Th0.6 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.015
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008614.cif $ #-------------------------------------------------------------------...
1,008,615
5.9644
0.0003
5.9644
0.0003
5.9644
0.0003
90
null
90
null
90
null
212.2
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.8/.2/2.4)
- F2.4 Pb0.8 Th0.2 -
- F2.376 Pb0.8 Th0.2 -
- F9.504 Pb3.2 Th0.8 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.016
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffraction de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008615.cif $ #-------------------------------------------------------------------...
1,008,616
5.9687
0.0003
5.9687
0.0003
5.9687
0.0003
90
null
90
null
90
null
212.6
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Lead thorium fluoride (.77/.23/2.46)
- F2.46 Pb0.77 Th0.23 -
- F2.456 Pb0.77 Th0.23 -
- F9.824 Pb3.08 Th0.92 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C
Etude par diffracton de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~
Solid State Ionics
1,981
2
215
229
10.1016/0167-2738(81)90181-8
null
0.022
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Hagenmueller, P; Lucat, C Etude par diffracton de neutrons de la solution solide Pb~1-x~ Th~x~ F~2+2x~ Solid State Ionics 2 (1981) 215-229
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/1/00/86/1008616.cif $ #-------------------------------------------------------------------...
1,008,617
8.383
0.007
8.383
0.007
8.383
0.007
90
null
90
null
90
null
589.1
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Cerium ruthenium deuteride (1/1.9/5.2)
- Ce D5.196 Ru1.86 -
- Ce D5.196 Ru1.86 -
- Ce8 D41.568 Ru14.88 -
8
0.041667
Fruchart, D; Vaillant, F; Roudaut, E; Nemoz, A; Tessema, X G
Etude par diffraction neutronique de Ce Ru~2~ D~5~
Physica Status Solidi, Sectio A: Applied Research
1,981
67
K19
K24
null
0.07
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Fruchart, D; Vaillant, F; Roudaut, E; Nemoz, A; Tessema, X G Etude par diffraction neutronique de Ce Ru~2~ D~5~ Physica Status Solidi, Sectio A: Applied Research 67 (1981) K19-K24
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/1/00/86/1008617.cif $ #-------------------------------------------------------------------...
7,015,470
12.9005
0.0011
14.3387
0.0012
16.4886
0.0013
71.04
0.001
81.626
0.001
65.462
0.001
2,623.8
0.4
298
2
298
2
null
null
null
null
5
P -1
-P 1
2
- C58 H42 Co3 N16 O3 -
- C58 H40 Co3 N16 O3 -
- C116 H80 Co6 N32 O6 -
2
1
Li, Bo; Zhang, Jingping; Yong, Xue; Li, Wenliang; Zheng, Yiying
The low spin Co(II) fragment with homoleptic 1,10-phenanthroline ligands: synthesis, structures, DFT investigations, and magnetic properties.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4459
4464
10.1039/c0dt01640c
0.71073
MoKα
0.0566
0.0438
null
null
0.1139
0.1212
null
null
null
null
null
1
null
null
has coordinates
Li, Bo; Zhang, Jingping; Yong, Xue; Li, Wenliang; Zheng, Yiying The low spin Co(II) fragment with homoleptic 1,10-phenanthroline ligands: synthesis, structures, DFT investigations, and magnetic properties. Dalton transactions (Cambridge, England : 2003) 40(17) (2011) 4459-4464
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015470.cif $ #-------------------------------------------------------------------...
1,008,618
5.9381
0.0004
5.9381
0.0004
5.9381
0.0004
90
null
90
null
90
null
209.4
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium bismuth fluoride (.5/.5/2)
- Bi0.5 F2 K0.5 -
- Bi0.5 F1.98 K0.5 -
- Bi2 F7.92 K2 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.06
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008618.cif $ #-------------------------------------------------------------------...
1,008,619
5.9391
0.0005
5.9391
0.0005
5.9391
0.0005
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
Potassium bismuth fluoride (.48/.52/2.04)
- Bi0.52 F2.04 K0.48 -
- Bi0.52 F2.06 K0.48 -
- Bi2.08 F8.24 K1.92 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.05
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008619.cif $ #-------------------------------------------------------------------...
1,008,620
5.9224
0.0004
5.9224
0.0004
5.9224
0.0004
90
null
90
null
90
null
207.7
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium bismuth fluoride (.45/.55/2.10)
- Bi0.55 F2.1 K0.45 -
- Bi0.55 F2.16 K0.45 -
- Bi2.2 F8.64 K1.8 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.033
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008620.cif $ #-------------------------------------------------------------------...
7,015,469
12.5638
0.0007
15.2175
0.0009
22.2295
0.0014
90
null
90
null
90
null
4,250
0.4
193.1
null
null
null
null
null
null
null
8
P 21 21 21
P 2ac 2ab
19
- C34 H44 Cl3 F6 N3 O9 P Rh -
- C34 H44 Cl3 F6 N3 O9 P Rh -
- C136 H176 Cl12 F24 N12 O36 P4 Rh4 -
4
1
Shibata, Teppei; Hashimoto, Hideki; Kinoshita, Isamu; Yano, Shigenobu; Nishioka, Takanori
Unprecedented diastereoselective generation of chiral-at-metal, half sandwich Ir(III) and Rh(III) complexes via anomeric isomerism on "sugar-coated" N-heterocyclic carbene ligands.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
4826
4829
10.1039/c0dt01634a
0.71075
MoKα
null
0.0454
null
null
null
0.1062
null
null
null
null
null
1.021
null
null
has coordinates
Shibata, Teppei; Hashimoto, Hideki; Kinoshita, Isamu; Yano, Shigenobu; Nishioka, Takanori Unprecedented diastereoselective generation of chiral-at-metal, half sandwich Ir(III) and Rh(III) complexes via anomeric isomerism on "sugar-coated" N-heterocyclic carbene ligands. Dalton transactions (Cambridge, England : 2003) 4...
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/7/01/54/7015469.cif $ #-------------------------------------------------------------------...
1,008,621
5.9142
0.0008
5.9142
0.0008
5.9142
0.0008
90
null
90
null
90
null
206.9
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium bismuth fluoride (.4/.6/2.2)
- Bi0.6 F2.2 K0.4 -
- Bi0.6 F2.2 K0.4 -
- Bi2.4 F8.8 K1.6 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.036
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008621.cif $ #-------------------------------------------------------------------...
1,008,622
5.8885
0.0003
5.8885
0.0003
5.8885
0.0003
90
null
90
null
90
null
204.2
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium bismuth fluoride (.35/.65/2.30)
- Bi0.65 F2.3 K0.35 -
- Bi0.65 F2.36 K0.35 -
- Bi2.6 F9.44 K1.4 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.026
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008622.cif $ #-------------------------------------------------------------------...
1,008,623
5.8895
0.0003
5.8895
0.0003
5.8895
0.0003
90
null
90
null
90
null
204.3
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium bismuth fluoride (.3/.7/2.4)
- Bi0.7 F2.4 K0.3 -
- Bi0.7 F2.42 K0.3 -
- Bi2.8 F9.68 K1.2 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.03
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008623.cif $ #-------------------------------------------------------------------...
7,015,468
12.6224
0.0013
15.2989
0.0018
22.254
0.003
90
null
90
null
90
null
4,297.4
0.9
193.1
null
null
null
null
null
null
null
8
P 21 21 21
P 2ac 2ab
19
- C35 H42 Cl F6 Ir N3 O12 P -
- C35 H42 Cl F6 Ir N3 O12 P -
- C140 H168 Cl4 F24 Ir4 N12 O48 P4 -
4
1
Shibata, Teppei; Hashimoto, Hideki; Kinoshita, Isamu; Yano, Shigenobu; Nishioka, Takanori
Unprecedented diastereoselective generation of chiral-at-metal, half sandwich Ir(III) and Rh(III) complexes via anomeric isomerism on "sugar-coated" N-heterocyclic carbene ligands.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
4826
4829
10.1039/c0dt01634a
0.7107
MoKα
null
0.0455
null
null
null
0.0968
null
null
null
null
null
1.002
null
null
has coordinates
Shibata, Teppei; Hashimoto, Hideki; Kinoshita, Isamu; Yano, Shigenobu; Nishioka, Takanori Unprecedented diastereoselective generation of chiral-at-metal, half sandwich Ir(III) and Rh(III) complexes via anomeric isomerism on "sugar-coated" N-heterocyclic carbene ligands. Dalton transactions (Cambridge, England : 2003) 4...
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/7/01/54/7015468.cif $ #-------------------------------------------------------------------...
1,008,624
6.0548
0.0004
6.0548
0.0004
6.0548
0.0004
90
null
90
null
90
null
222
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Rubidium bismuth fluoride (.5/.5/2)
- Bi0.5 F2 Rb0.5 -
- Bi0.5 F1.98 Rb0.5 -
- Bi2 F7.92 Rb2 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.085
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008624.cif $ #-------------------------------------------------------------------...
1,008,625
6.0567
0.0012
6.0567
0.0012
6.0567
0.0012
90
null
90
null
90
null
222.2
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Rubidium bismuth fluoride (.48/.52/2.04)
- Bi0.52 F2.04 Rb0.48 -
- Bi0.52 F1.98 Rb0.48 -
- Bi2.08 F7.92 Rb1.92 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.077
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008625.cif $ #-------------------------------------------------------------------...
1,008,626
6.0445
0.0004
6.0445
0.0004
6.0445
0.0004
90
null
90
null
90
null
220.8
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Rubidium bismuth fluoride (.45/.55/2.10)
- Bi0.55 F2.1 Rb0.45 -
- Bi0.55 F2.08 Rb0.45 -
- Bi2.2 F8.32 Rb1.8 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.044
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008626.cif $ #-------------------------------------------------------------------...
1,008,627
6.0423
0.0012
6.0423
0.0012
6.0423
0.0012
90
null
90
null
90
null
220.6
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Rubidium bismuth fluoride (.4/.6/2.2)
- Bi0.6 F2.2 Rb0.4 -
- Bi0.6 F2.16 Rb0.4 -
- Bi2.4 F8.64 Rb1.6 -
4
0.020833
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P
Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~
Solid State Ionics
1,982
6
103
111
10.1016/0167-2738(82)90102-3
null
0.049
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Matar, S; Villeneuve, G; Hagenmueller, P Etude par diffraction neutronique des solutions solides K~1-x~ Bi~x~ F~1+2x~ et Rb~1-x~ Bi~x~ F~1+2x~ Solid State Ionics 6 (1982) 103-111
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/1/00/86/1008627.cif $ #-------------------------------------------------------------------...
7,015,467
10.9023
0.0012
14.8954
0.0018
21.769
0.003
99.731
0.012
98.469
0.009
104.467
0.01
3,306.6
0.8
100
1
100
1
null
null
null
null
6
P -1
-P 1
2
- C54 H108 O13 P Rh Si8 -
- C54 H108 O13 P Rh Si8 -
- C108 H216 O26 P2 Rh2 Si16 -
2
1
Marciniec, Bogdan; Kownacki, Ireneusz; Franczyk, Adrian; Kubicki, Maciej
Silsesquioxyl rhodium(I) complexes–synthesis, structure and catalytic activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
5073
5077
10.1039/c0dt01631d
0.71073
MoKα
0.0958
0.0563
null
null
0.1313
0.1368
null
null
null
null
null
0.96
null
null
has coordinates,has disorder
Marciniec, Bogdan; Kownacki, Ireneusz; Franczyk, Adrian; Kubicki, Maciej Silsesquioxyl rhodium(I) complexes–synthesis, structure and catalytic activity. Dalton transactions (Cambridge, England : 2003) 40(18) (2011) 5073-5077
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/7/01/54/7015467.cif $ #-------------------------------------------------------------------...
1,008,628
12.376
null
12.376
null
12.376
null
90
null
90
null
90
null
1,895.6
null
null
null
null
null
null
null
null
null
3
I a -3 d
-I 4bd 2c 3
230
Triyttrium pentairon(III) oxide
- Fe5 O12 Y3 -
- Fe5 O12 Y3 -
- Fe40 O96 Y24 -
8
0.083333
Bertaut, F; Forrat, F; Herpin, A; Meriel, P
Etude par diffraction de neutrons du grenat ferrimagnetique Y~3~ Fe~5~ O~12~
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965)
1,956
243
898
901
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bertaut, F; Forrat, F; Herpin, A; Meriel, P Etude par diffraction de neutrons du grenat ferrimagnetique Y~3~ Fe~5~ O~12~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 243 (1956) 898-901
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/1/00/86/1008628.cif $ #-------------------------------------------------------------------...
1,008,629
6.627
0.001
6.627
0.001
6.627
0.001
90
null
90
null
90
null
291
null
null
null
null
null
null
null
null
null
2
P m -3 m
-P 4 2 3
221
Uranium trideuteride -β
- D3 U -
- D3 U -
- D24 U8 -
8
0.166667
Bartscher, W.; Boeuf, A.; Caciuffo, R.; Fournier, J. M.; Kuhs, W. F.; Rebizant, J.; Rustichelli, F.
Neutron diffraction study of β-UD~3~ and β-UH~3~
Solid State Communications
1,985
53
53
423
426
10.1016/0038-1098(85)91000-2
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bartscher, W.; Boeuf, A.; Caciuffo, R.; Fournier, J. M.; Kuhs, W. F.; Rebizant, J.; Rustichelli, F. Neutron diffraction study of β-UD~3~ and β-UH~3~ Solid State Communications 53(53) (1985) 423-426
200,124
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-02 14:31:52 +0300 (Sat, 02 Sep 2017) $ #$Revision: 200124 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/86/1008629.cif $ #-------------------------------------------------------------------...
1,008,630
6.643
0.001
6.643
0.001
6.643
0.001
90
null
90
null
90
null
293.2
null
null
null
null
null
null
null
null
null
2
P m -3 m
-P 4 2 3
221
Uranium trihydride - β
- H3 U -
- H3 U -
- H24 U8 -
8
0.166667
Bartscher, W.; Boeuf, A.; Caciuffo, R.; Fournier, J. M.; Kuhs, W. F.; Rebizant, J.; Rustichelli, F.
Neutron diffraction study of β-U D~3~ and β-U H~3~
Solid State Communications
1,985
53
53
423
426
10.1016/0038-1098(85)91000-2
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bartscher, W.; Boeuf, A.; Caciuffo, R.; Fournier, J. M.; Kuhs, W. F.; Rebizant, J.; Rustichelli, F. Neutron diffraction study of β-U D~3~ and β-U H~3~ Solid State Communications 53(53) (1985) 423-426
200,124
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-02 14:31:52 +0300 (Sat, 02 Sep 2017) $ #$Revision: 200124 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/86/1008630.cif $ #-------------------------------------------------------------------...
1,008,631
9.4312
0.0005
9.4312
0.0005
9.4312
0.0005
90
null
90
null
90
null
838.9
null
null
null
null
null
null
null
null
null
4
I a -3
-I 2b 2c 3
206
Copper titanium ferrate *
- Cu0.6667 Fe0.6667 O3 Ti0.6667 -
- Cu0.6666 Fe0.6666 O3 Ti0.6666 -
- Cu10.6656 Fe10.6656 O48 Ti10.6656 -
16
0.333333
Mouron, P; Odier, P; Choisnet, J
Titanates de cuivre substitues a structure bixbyite: Les composes Cu~1- x~ Ti~1-x~ Fe~2x~ O~3~ (0.15<x<0.33)
Journal of Solid State Chemistry
1,985
60
87
94
10.1016/0022-4596(85)90167-7
null
0.071
null
null
null
null
null
null
null
null
null
null
null
1,001,551
null
has coordinates
Mouron, P; Odier, P; Choisnet, J Titanates de cuivre substitues a structure bixbyite: Les composes Cu~1- x~ Ti~1-x~ Fe~2x~ O~3~ (0.15<x<0.33) Journal of Solid State Chemistry 60 (1985) 87-94
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/1/00/86/1008631.cif $ #-------------------------------------------------------------------...
7,015,466
20.084
0.002
19.082
0.002
28.57
0.003
90
null
98.94
0.01
90
null
10,816
2
295
2
295
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
- C72 H150 O26 Rh2 Si16 -
- C72 H150 O26 Rh2 Si16 -
- C288 H600 O104 Rh8 Si64 -
4
0.5
Marciniec, Bogdan; Kownacki, Ireneusz; Franczyk, Adrian; Kubicki, Maciej
Silsesquioxyl rhodium(I) complexes–synthesis, structure and catalytic activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
5073
5077
10.1039/c0dt01631d
0.71073
MoKα
0.1098
0.0683
null
null
0.1946
0.2041
null
null
null
null
null
1.181
null
null
has coordinates,has disorder
Marciniec, Bogdan; Kownacki, Ireneusz; Franczyk, Adrian; Kubicki, Maciej Silsesquioxyl rhodium(I) complexes–synthesis, structure and catalytic activity. Dalton transactions (Cambridge, England : 2003) 40(18) (2011) 5073-5077
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/7/01/54/7015466.cif $ #-------------------------------------------------------------------...
1,008,632
9.4312
0.0005
9.4312
0.0005
9.4312
0.0005
90
null
90
null
90
null
838.9
null
null
null
null
null
null
null
null
null
4
I a -3
-I 2b 2c 3
206
Copper titanium iron oxide (0.66/0.66/0.66/3)
- Cu0.66 Fe0.66 O3 Ti0.66 -
- Cu0.66 Fe0.66 O3 Ti0.66 -
- Cu10.56 Fe10.56 O48 Ti10.56 -
16
0.333333
Mouron, P; Odier, P; Choisnet, J
Titanates des cuivre substitues a structure bixbyite: Les composes Cu~1- x~ Ti1~-x~ Fe~2x~ O~3~ (0.15 <= X <= 0.33)
Journal of Solid State Chemistry
1,985
60
87
94
10.1016/0022-4596(85)90167-7
null
0.071
null
null
null
null
null
null
null
null
null
null
null
1,001,552
null
has coordinates
Mouron, P; Odier, P; Choisnet, J Titanates des cuivre substitues a structure bixbyite: Les composes Cu~1- x~ Ti1~-x~ Fe~2x~ O~3~ (0.15 <= X <= 0.33) Journal of Solid State Chemistry 60 (1985) 87-94
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/1/00/86/1008632.cif $ #-------------------------------------------------------------------...
1,008,633
7.455
null
7.455
null
7.455
null
90
null
90
null
90
null
414.3
null
null
null
null
null
null
null
null
null
4
I m -3
-I 2 2 3
204
Neodymium copper ruthenium oxide (1/3/4/12)
- Cu3 Nd O12 Ru4 -
- Cu3 Nd O12 Ru4 -
- Cu6 Nd2 O24 Ru8 -
2
0.041667
Muller, J; Haouzi, A; Laviron, C; Labeau, M; Joubert, J C
Conductivie electrique et caracterisation cristallographique des composes type perovskite Nd Cu~3~ Ru~x~ Ti~4-x~ O~12~ (1<x<4) et Nd~(2+x)/3~ Cu~3~ Ru~x~ Ti~4-x~ O~12~ (x<1)
Materials Research Bulletin
1,986
21
1131
1136
10.1016/0025-5408(86)90230-8
null
0.025
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Muller, J; Haouzi, A; Laviron, C; Labeau, M; Joubert, J C Conductivie electrique et caracterisation cristallographique des composes type perovskite Nd Cu~3~ Ru~x~ Ti~4-x~ O~12~ (1<x<4) et Nd~(2+x)/3~ Cu~3~ Ru~x~ Ti~4-x~ O~12~ (x<1) Materials Research Bulletin 21 (1986) 1131-1136
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/1/00/86/1008633.cif $ #-------------------------------------------------------------------...
1,008,634
7.1226
0.0001
7.1226
0.0001
66.2
0.1
90
null
90
null
90
null
3,358.4
null
null
null
null
null
null
null
null
null
3
P 42/n :2
-P 4bc
86
Neodymium iron boride (19/68/68)
- B68 Fe68 Nd19 -
- B68 Fe68 Nd19 -
- B136 Fe136 Nd38 -
2
0.25
Bezinge, A; Yvon, K; Braun, H F; Muller, J; Nissen, H U
Nd~1+e~ Fe~4~ B~4~: A composition-modulated compound with incommensurate composite crystal structure.
Physical Review, Serie 3. B - Condensed Matter (18,1978-)
1,987
36
1406
1414
10.1103/PhysRevB.36.1406
null
0.12
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bezinge, A; Yvon, K; Braun, H F; Muller, J; Nissen, H U Nd~1+e~ Fe~4~ B~4~: A composition-modulated compound with incommensurate composite crystal structure. Physical Review, Serie 3. B - Condensed Matter (18,1978-) 36 (1987) 1406-1414
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/1/00/86/1008634.cif $ #-------------------------------------------------------------------...
1,008,635
5.49
0.01
5.49
0.01
12.17
0.02
90
null
90
null
90
null
366.8
null
null
null
null
null
null
null
null
null
3
P 42/n c m :2
-P 4ac 2ac
138
Praseodymium nickel oxide
- Ni O4 Pr2 -
- Ni O4 Pr2 -
- Ni4 O16 Pr8 -
4
0.25
Fernandez-Diaz, M T; Martinez, J L; Rodriguez-Carvajal, J; Beille, J; Martinez, B; Obradors, X; Odier, P
Metamagnetism in single-crystal Pr2NiO4
Physical Review, Serie 3. B - Condensed Matter (18,1978-)
1,993
47
5834
5840
10.1103/PhysRevB.47.5834
null
0.036
null
null
null
null
null
null
null
null
null
null
null
1,006,058
null
has coordinates
Fernandez-Diaz, M T; Martinez, J L; Rodriguez-Carvajal, J; Beille, J; Martinez, B; Obradors, X; Odier, P Metamagnetism in single-crystal Pr2NiO4 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 47 (1993) 5834-5840
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/1/00/86/1008635.cif $ #-------------------------------------------------------------------...
7,015,465
10.9457
0.0012
21.357
0.002
15.7609
0.0017
90
null
95.597
0.002
90
null
3,666.8
0.7
120
2
120
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C30 H42 Br2 Cl6 N2 -
- C30 H42 Br2 Cl6 N2 -
- C120 H168 Br8 Cl24 N8 -
4
1
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S.
Dual reactivity of N-heterocyclic carbenes towards copper(II) salts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3074
3076
10.1039/c0dt01630f
0.71073
MoKα
0.1278
0.0574
null
null
0.1252
0.1398
null
null
null
null
null
0.871
null
null
has coordinates
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S. Dual reactivity of N-heterocyclic carbenes towards copper(II) salts. Dalton transactions (Cambridge, England : 2003) 40(12) (2011) 3074-3076
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/7/01/54/7015465.cif $ #-------------------------------------------------------------------...
1,008,636
8.4325
0.0008
8.4325
0.0001
8.4325
0.0001
90
null
90
null
90
null
599.6
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Lithium iron oxide (9.3/21.3/32)
- Fe21.34 Li9.28 O32 -
- Fe21.336 Li9.28 O32 -
- Fe21.336 Li9.28 O32 -
1
0.005208
Pernet, M.; Strobel, P.; Bonnet, B.; Bordet, P.; Chabre, Y.
Structural and electrochemical study of lithium insertion into γ-Fe~2~O~3~
Solid State Ionics
1,993
66
259
265
10.1016/0167-2738(93)90415-Y
null
0.0565
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pernet, M.; Strobel, P.; Bonnet, B.; Bordet, P.; Chabre, Y. Structural and electrochemical study of lithium insertion into γ-Fe~2~O~3~ Solid State Ionics 66 (1993) 259-265
189,456
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-12-27 17:03:18 +0200 (Tue, 27 Dec 2016) $ #$Revision: 189456 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/86/1008636.cif $ #-------------------------------------------------------------------...
1,008,637
8.4328
0.0008
8.4328
0.0001
8.4328
0.0001
90
null
90
null
90
null
599.7
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Lithium iron oxide (9.1/21.3/32)
- Fe21.33 Li9.07 O32 -
- Fe21.336 Li9.072 O32 -
- Fe21.336 Li9.072 O32 -
1
0.005208
Pernet, M.; Strobel, P.; Bonnet, B.; Bordet, P.; Chabre, Y.
Structural and electrochemical study of lithium insertion into γ-Fe~2~O~3~
Solid State Ionics
1,993
66
259
265
10.1016/0167-2738(93)90415-Y
null
0.0737
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pernet, M.; Strobel, P.; Bonnet, B.; Bordet, P.; Chabre, Y. Structural and electrochemical study of lithium insertion into γ-Fe~2~O~3~ Solid State Ionics 66 (1993) 259-265
189,456
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-12-27 17:03:18 +0200 (Tue, 27 Dec 2016) $ #$Revision: 189456 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/00/86/1008637.cif $ #-------------------------------------------------------------------...
1,008,638
3.8984
0.0003
3.8984
0.0003
11.613
0.001
90
null
90
null
90
null
176.5
null
null
null
null
null
null
null
null
null
4
P 4/m m m
-P 4 2
123
Barium praseodymium copper oxide (2/1/3/6.9)
- Ba2 Cu3 O6.9 Pr -
- Ba2 Cu3 O6.9 Pr -
- Ba2 Cu3 O6.9 Pr -
1
0.0625
Amador, U; Moran, E; Alario-Franco, M A; Ibanez, J; Martin, J; Rey, T S
On the oxidation-reduction of Ba~2~PrCu~3~O~y~ single crystals
Solid State Ionics
1,993
63
858
865
null
0.0372
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Amador, U; Moran, E; Alario-Franco, M A; Ibanez, J; Martin, J; Rey, T S On the oxidation-reduction of Ba~2~PrCu~3~O~y~ single crystals Solid State Ionics 63 (1993) 858-865
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/1/00/86/1008638.cif $ #-------------------------------------------------------------------...
1,008,639
3.8918
0.0002
3.8918
0.0002
11.6484
0.0008
90
null
90
null
90
null
176.4
null
null
null
null
null
null
null
null
null
4
P 4/m m m
-P 4 2
123
Barium praseodymium copper oxide (2/1/3/6.98)
- Ba2 Cu3 O6.98 Pr -
- Ba2 Cu3 O6.984 Pr -
- Ba2 Cu3 O6.984 Pr -
1
0.0625
Amador, U; Moran, E; Alario-Franco, M A; Ibanez, J; Martin, J; Rey, T S
On the oxidation-reduction of Ba~2~PrCu~3~O~y~ single crystals
Solid State Ionics
1,993
63
858
865
null
0.0394
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Amador, U; Moran, E; Alario-Franco, M A; Ibanez, J; Martin, J; Rey, T S On the oxidation-reduction of Ba~2~PrCu~3~O~y~ single crystals Solid State Ionics 63 (1993) 858-865
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/1/00/86/1008639.cif $ #-------------------------------------------------------------------...
1,008,640
3.9048
0.0003
3.9048
0.0003
11.648
0.001
90
null
90
null
90
null
177.6
null
null
null
null
null
null
null
null
null
4
P 4/m m m
-P 4 2
123
Barium praseodymium copper oxide (2/1/3/7.5)
- Ba2 Cu3 O7.5 Pr -
- Ba2 Cu3 O7.5 Pr -
- Ba2 Cu3 O7.5 Pr -
1
0.0625
Amador, U; Moran, E; Alario-Franco, M A; Ibanez, J; Martin, J; Rey, T S
On the oxidation-reduction of Ba~2~PrCu~3~O~y~ single crystals
Solid State Ionics
1,993
63
858
865
null
0.0377
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Amador, U; Moran, E; Alario-Franco, M A; Ibanez, J; Martin, J; Rey, T S On the oxidation-reduction of Ba~2~PrCu~3~O~y~ single crystals Solid State Ionics 63 (1993) 858-865
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/1/00/86/1008640.cif $ #-------------------------------------------------------------------...
7,015,464
23.7798
0.0011
8.8383
0.0004
16.8227
0.0014
90
null
134.886
0.001
90
null
2,505.1
0.3
100
2
100
2
null
null
null
null
5
C 1 c 1
C -2yc
9
- C26 H34 Cu N2 O4 -
- C26 H34 Cu N2 O4 -
- C104 H136 Cu4 N8 O16 -
4
1
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S.
Dual reactivity of N-heterocyclic carbenes towards copper(II) salts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3074
3076
10.1039/c0dt01630f
0.71073
MoKα
0.0963
0.0757
null
null
0.1762
0.1994
null
null
null
null
null
1.018
null
null
has coordinates
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S. Dual reactivity of N-heterocyclic carbenes towards copper(II) salts. Dalton transactions (Cambridge, England : 2003) 40(12) (2011) 3074-3076
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015464.cif $ #-------------------------------------------------------------------...
1,008,641
8.5325
null
8.5325
null
12.4554
null
90
null
90
null
120
null
785.3
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Niobium iron silicide (2/12.9/4.1)
- Fe12.91 Nd2 Si4.09 -
- Fe12.908 Nd2 Si4.092 -
- Fe38.724 Nd6 Si12.276 -
3
0.083333
Long, G J; Marasinghe, G K; Mishra, S; Pringle, O A; Grandjean, F; Buschow, K H J; Middleton, D P; Yelon, W B; Pourarian, F; Isnard, O
A neutron diffraction and Moessbauer effect study of the Nd~2~Fe~17- x~Si~x~ solid solutions
Solid State Communications
1,993
88
10
761
764
10.1016/0038-1098(93)90872-K
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Long, G J; Marasinghe, G K; Mishra, S; Pringle, O A; Grandjean, F; Buschow, K H J; Middleton, D P; Yelon, W B; Pourarian, F; Isnard, O A neutron diffraction and Moessbauer effect study of the Nd~2~Fe~17- x~Si~x~ solid solutions Solid State Communications 88(10) (1993) 761-764
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/1/00/86/1008641.cif $ #-------------------------------------------------------------------...
1,008,642
8.276
0.001
8.276
0.001
4.82
0.001
90
null
90
null
90
null
330.1
null
null
null
null
null
null
null
null
null
4
P 4/m b m
-P 4 2ab
127
Yttrium iron titanium deuteride (2/17.2/2.3/2.4)
- D2.35 Fe17.17 Ti2.28 Y2 -
- D2.352 Fe17.168 Ti2.288 Y2 -
- D2.352 Fe17.168 Ti2.288 Y2 -
1
0.0625
Revel, R; Tomey, E; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Crystal structure and magnetic properties of the ternary compound YFe~8.6~Ti~1.1~ and its hydride
Journal of Alloys Compd.
1,993
202
57
61
10.1016/0925-8388(93)90517-Q
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Revel, R; Tomey, E; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Crystal structure and magnetic properties of the ternary compound YFe~8.6~Ti~1.1~ and its hydride Journal of Alloys Compd. 202 (1993) 57-61
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/1/00/86/1008642.cif $ #-------------------------------------------------------------------...
1,008,643
5.4644
0.0001
5.457
0.0001
12.7035
0.0002
90
null
90
null
90
null
378.8
null
null
null
null
null
null
null
null
null
3
F m m m
-F 2 2
69
Lanthanum nickel oxide (2/1/4.2)
- La2 Ni O4.24 -
- La2 Ni O4.2396 -
- La8 Ni4 O16.9584 -
4
0.125
Demourgues, A; Wattiaux, A; Grenier, J C; Pouchard, M; Soubeyroux, J L; Dance, J M; Hagenmuller, P
Electrochemical preparation and structural characterization of La~2~NiO~4+d~ phases (0<d<0.25)
Journal of Solid State Chemistry
1,993
105
458
468
10.1006/jssc.1993.1238
null
0.045
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Demourgues, A; Wattiaux, A; Grenier, J C; Pouchard, M; Soubeyroux, J L; Dance, J M; Hagenmuller, P Electrochemical preparation and structural characterization of La~2~NiO~4+d~ phases (0<d<0.25) Journal of Solid State Chemistry 105 (1993) 458-468
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/1/00/86/1008643.cif $ #-------------------------------------------------------------------...
7,015,463
8.48
0.003
12.416
0.004
12.623
0.004
83.44
0.007
73.973
0.006
71.022
0.006
1,207.5
0.7
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
- C25 H30 Cu N2 O4 -
- C25 H30 Cu N2 O4 -
- C50 H60 Cu2 N4 O8 -
2
1
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S.
Dual reactivity of N-heterocyclic carbenes towards copper(II) salts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3074
3076
10.1039/c0dt01630f
0.71073
MoKα
0.1008
0.081
null
null
0.2021
0.213
null
null
null
null
null
1.007
null
null
has coordinates
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S. Dual reactivity of N-heterocyclic carbenes towards copper(II) salts. Dalton transactions (Cambridge, England : 2003) 40(12) (2011) 3074-3076
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015463.cif $ #-------------------------------------------------------------------...
1,008,644
5.55548
0.00004
7.84868
0.00006
5.55349
0.00005
90
null
90
null
90
null
242.1
null
null
null
null
null
null
null
null
null
3
P n m a
-P 2ac 2n
62
Lanthanum vanadate(III)
- La O3 V -
- La O3 V -
- La4 O12 V4 -
4
0.5
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B
Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K
Journal of Solid State Chemistry
1,993
106
253
270
10.1006/jssc.1993.1285
null
0.04
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K Journal of Solid State Chemistry 106 (1993) 253-270
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/1/00/86/1008644.cif $ #-------------------------------------------------------------------...
1,008,645
5.5581
0.00004
7.83421
0.00006
5.54862
0.00005
90
null
90
null
90
null
241.6
null
null
null
null
null
null
null
null
null
3
P n m a
-P 2ac 2n
62
Lanthanum vanadate(III)
- La O3 V -
- La O3 V -
- La4 O12 V4 -
4
0.5
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B
Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K
Journal of Solid State Chemistry
1,993
106
253
270
10.1006/jssc.1993.1285
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K Journal of Solid State Chemistry 106 (1993) 253-270
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/1/00/86/1008645.cif $ #-------------------------------------------------------------------...
1,008,646
5.5936
0.00004
7.75951
0.00005
5.5649
0.00003
90
null
90
null
90.125
0.0004
241.5
null
null
null
null
null
null
null
null
null
3
P 1 1 21/a
-P 2ac
14
Lanthanum vanadate(III)
- La O3 V -
- La O3 V -
- La4 O12 V4 -
4
1
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B
Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K
Journal of Solid State Chemistry
1,993
106
253
270
10.1006/jssc.1993.1285
null
0.046
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K Journal of Solid State Chemistry 106 (1993) 253-270
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/1/00/86/1008646.cif $ #-------------------------------------------------------------------...
1,008,647
5.5917
0.0003
7.7516
0.0004
5.5623
0.0003
90
null
90
null
90.129
0.006
241.1
null
null
null
null
null
null
null
null
null
3
P 1 1 21/a
-P 2ac
14
Lanthanum vanadate(III)
- La O3 V -
- La O3 V -
- La4 O12 V4 -
4
1
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B
Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K
Journal of Solid State Chemistry
1,993
106
253
270
10.1006/jssc.1993.1285
null
0.054
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bordet, P; Chaillout, C; Marezio, M; Huang, Q; Santoro, A; Cheong, S-W; Takagi, H; Oglesby, C S; Batlogg, B Structural aspects of the crystallographic-magnetic transition in LaVO~3~ around 140 K Journal of Solid State Chemistry 106 (1993) 253-270
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/1/00/86/1008647.cif $ #-------------------------------------------------------------------...
7,015,462
19.4962
0.0009
19.3988
0.0009
15.5513
0.0007
90
null
91.827
0.001
90
null
5,878.6
0.5
100
2
100
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C28 H40 Br3 Cu N2 -
- C28 H40 Br3 Cu N2 -
- C224 H320 Br24 Cu8 N16 -
8
2
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S.
Dual reactivity of N-heterocyclic carbenes towards copper(II) salts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3074
3076
10.1039/c0dt01630f
0.71073
MoKα
0.0651
0.0338
null
null
0.0631
0.0717
null
null
null
null
null
1.001
null
null
has coordinates
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S. Dual reactivity of N-heterocyclic carbenes towards copper(II) salts. Dalton transactions (Cambridge, England : 2003) 40(12) (2011) 3074-3076
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015462.cif $ #-------------------------------------------------------------------...
1,008,648
3.8706
0.0004
3.8706
0.0004
11.612
0.001
90
null
90
null
90
null
174
null
null
null
null
null
null
null
null
null
5
P 4/m m m
-P 4 2
123
Yttrium barium copper carbonate oxide (1/2/2.95/0.35/6.6)
- C0.35 Ba2 Cu2.95 O7.65 Y -
- C0.35 Ba2 Cu2.95 O7.64 Y -
- C0.35 Ba2 Cu2.95 O7.64 Y -
1
0.0625
Gotor, F J; Odier, P; Gervais, M; Choisnet, J; Monod, Ph
Synthesis of YBa~2~Cu~3~O~7-x~ by sol-gel route. Formation of YBaCuO oxycarbonate intermediate
Physica C (Amsterdam) (152,1988-)
1,993
218
429
436
10.1016/0921-4534(93)90046-S
null
0.055
null
null
null
null
null
null
null
null
null
null
null
1,001,578
null
has coordinates
Gotor, F J; Odier, P; Gervais, M; Choisnet, J; Monod, Ph Synthesis of YBa~2~Cu~3~O~7-x~ by sol-gel route. Formation of YBaCuO oxycarbonate intermediate Physica C (Amsterdam) (152,1988-) 218 (1993) 429-436
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/1/00/86/1008648.cif $ #-------------------------------------------------------------------...
1,008,649
3.8184
0.0003
3.8857
0.0002
11.701
0.001
90
null
90
null
90
null
173.6
null
null
null
null
null
null
null
null
null
4
P m m m
-P 2 2
47
Yttrium barium copper oxide (1/2/3/6.9)
- Ba2 Cu3 O6.877 Y -
- Ba2 Cu3 O6.877 Y -
- Ba2 Cu3 O6.877 Y -
1
0.125
Sullivan, J D; Bordet, P; Marezio, M; Takenaka, K; Uchida, S
Electron-density Fourier maps of an untwinned YBa~2~Cu~3~O~6.877~ single crystal by x-ray-diffraction data
Physical Review, Serie 3. B - Condensed Matter (18,1978-)
1,993
48
14
10638
10641
10.1103/PhysRevB.48.10638
null
0.035
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Sullivan, J D; Bordet, P; Marezio, M; Takenaka, K; Uchida, S Electron-density Fourier maps of an untwinned YBa~2~Cu~3~O~6.877~ single crystal by x-ray-diffraction data Physical Review, Serie 3. B - Condensed Matter (18,1978-) 48(14) (1993) 10638-10641
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/1/00/86/1008649.cif $ #-------------------------------------------------------------------...
1,008,650
17.06099
0.003
11.41
0.002
7.687
0.002
90
null
102.29
0.02
90
null
1,462.1
null
null
null
null
null
null
null
null
null
4
C 1 2/m 1
-C 2y
12
Heptabarium manganese hexairon(III) fluoride
- Ba7 F34 Fe6 Mn -
- Ba7 F34 Fe6 Mn -
- Ba14 F68 Fe12 Mn2 -
2
0.25
le Lirzin, A; Soubeyroux, J L; Tressaud, A; Georges, R; Darriet, J
Systemes magnetiques de basse dimensionnalite dans des fluorures de type usovite et jarlite
Journal de Chimie Physique et de Physico-Chimie Biologique
1,991
88
2173
2189
null
0.083
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
le Lirzin, A; Soubeyroux, J L; Tressaud, A; Georges, R; Darriet, J Systemes magnetiques de basse dimensionnalite dans des fluorures de type usovite et jarlite Journal de Chimie Physique et de Physico-Chimie Biologique 88 (1991) 2173-2189
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/1/00/86/1008650.cif $ #-------------------------------------------------------------------...
1,008,651
5.865
0.001
5.865
0.001
43.48599
0.004
90
null
90
null
120
null
1,295.4
null
null
null
null
null
null
null
null
null
4
R -3 m :H
-R 3 2"
166
Barium magnesium iron oxide (0.99/0.7/6.3/11)
- Ba0.99 Fe6.295 Mg0.705 O11 -
- Ba0.99 Fe6.295 Mg0.705 O11 -
- Ba5.94 Fe37.77 Mg4.23 O66 -
6
0.166667
Collomb, A; Muller, J; Fournier, T
Magnesium location in the barium-magnesium-iron Y-type hexagonal ferrite
Materials Research Bulletin
1,993
28
621
627
10.1016/0025-5408(93)90105-M
null
0.017
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Collomb, A; Muller, J; Fournier, T Magnesium location in the barium-magnesium-iron Y-type hexagonal ferrite Materials Research Bulletin 28 (1993) 621-627
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/1/00/86/1008651.cif $ #-------------------------------------------------------------------...
7,015,461
10.6908
0.001
10.7644
0.001
14.4174
0.0014
91.27
0.002
102.251
0.002
106.937
0.002
1,544.8
0.3
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
- C28 H40 Br4 Cu N2 -
- C28 H40 Br4 Cu N2 -
- C56 H80 Br8 Cu2 N4 -
2
1
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S.
Dual reactivity of N-heterocyclic carbenes towards copper(II) salts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3074
3076
10.1039/c0dt01630f
0.71073
MoKα
0.0588
0.0368
null
null
0.084
0.091
null
null
null
null
null
1.007
null
null
has coordinates
Kolychev, Eugene L.; Shuntikov, Viacheslav V.; Khrustalev, Victor N.; Bush, Alexander A.; Nechaev, Mikhail S. Dual reactivity of N-heterocyclic carbenes towards copper(II) salts. Dalton transactions (Cambridge, England : 2003) 40(12) (2011) 3074-3076
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015461.cif $ #-------------------------------------------------------------------...
1,008,652
5.399
0.001
5.399
0.001
8.828
0.002
90
null
90
null
120
null
222.9
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese aluminium deuteride (1/1.6/0.4/2.8)
- Al0.384 D2.76 Mn1.616 Zr -
- Al0.384 D2.7585 Mn1.616 Zr -
- Al1.536 D11.034 Mn6.464 Zr4 -
4
0.166667
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I
Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides
Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main)
1,993
179
187
198
10.1524/zpch.1993.179.Part_1_2.187
null
0.018
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main) 179 (1993) 187-198
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/1/00/86/1008652.cif $ #-------------------------------------------------------------------...
1,008,653
5.4616
0.0004
5.4616
0.0004
8.8959
0.0006
90
null
90
null
120
null
229.8
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese vanadium deuteride (1/1.6/0.4/3.5)
- D3.54 Mn1.601 V0.399 Zr -
- D3.54 Mn1.601 V0.399 Zr -
- D14.16 Mn6.404 V1.596 Zr4 -
4
0.166667
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I
Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides
Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main)
1,993
179
187
198
10.1524/zpch.1993.179.Part_1_2.187
null
0.011
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main) 179 (1993) 187-198
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/1/00/86/1008653.cif $ #-------------------------------------------------------------------...
7,015,460
19.06
0.004
17.898
0.004
13.932
0.003
90
null
111.66
0.03
90
null
4,417.1
1.9
170
null
170
null
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
- C20 H12 N2 O4 Zn -
- C20 H11 N2 O4 Zn -
- C160 H88 N16 O32 Zn8 -
8
1
Modrow, Antje; Zargarani, Dordaneh; Herges, Rainer; Stock, Norbert
The first porous MOF with photoswitchable linker molecules.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4217
4222
10.1039/c0dt01629b
0.71073
MoKα
0.0545
0.0418
null
null
0.1202
0.1288
null
null
null
null
null
0.967
null
null
has coordinates,has disorder
Modrow, Antje; Zargarani, Dordaneh; Herges, Rainer; Stock, Norbert The first porous MOF with photoswitchable linker molecules. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4217-4222
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015460.cif $ #-------------------------------------------------------------------...
1,008,654
5.3935
0.0008
5.3935
0.0008
8.791
0.002
90
null
90
null
120
null
221.5
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese iron deuteride (1/1.6/0.4/3.2)
- D3.22 Fe0.366 Mn1.634 Zr -
- D3.22035 Fe0.366 Mn1.634 Zr -
- D12.8814 Fe1.464 Mn6.536 Zr4 -
4
0.166667
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I
Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides
Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main)
1,993
179
187
198
10.1524/zpch.1993.179.Part_1_2.187
null
0.013
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main) 179 (1993) 187-198
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/1/00/86/1008654.cif $ #-------------------------------------------------------------------...
1,008,655
5.3915
0.0007
5.3915
0.0007
8.78
0.001
90
null
90
null
120
null
221
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese cobalt deuteride (1/1.5/0.5/3.4)
- Co0.477 D3.36 Mn1.523 Zr -
- Co0.477 D3.3603 Mn1.523 Zr -
- Co1.908 D13.4412 Mn6.092 Zr4 -
4
0.166667
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I
Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides
Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main)
1,993
179
187
198
10.1524/zpch.1993.179.Part_1_2.187
null
0.009
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main) 179 (1993) 187-198
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/1/00/86/1008655.cif $ #-------------------------------------------------------------------...
1,008,656
5.371
0.003
5.371
0.003
8.729
0.005
90
null
90
null
120
null
218.1
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese nickel deuteride (1/1.7/0.3/2.9)
- D2.85 Mn1.658 Ni0.342 Zr -
- D2.8497 Mn1.658 Ni0.342 Zr -
- D11.3988 Mn6.632 Ni1.368 Zr4 -
4
0.166667
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I
Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides
Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main)
1,993
179
187
198
10.1524/zpch.1993.179.Part_1_2.187
null
0.011
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Pontonnier, L; Miraglia, S; Isnard, O; Fruchart, D; Akiba, E; Hayakawa, H; Fujitani, S; Yonezu, I Crystal structure and microstructure analysis of alloys Zr(Mn~1- x~M~x~)~2~H~y~ with M=V,Fe,Co,Ni,Al and their hydrides Zeitschrift fuer Physikalische Chemie (Frankfurt Am Main) 179 (1993) 187-198
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/1/00/86/1008656.cif $ #-------------------------------------------------------------------...
7,015,459
11.126
0.003
14.949
0.004
18.944
0.005
67.746
0.007
89.809
0.01
82.927
0.009
2,890.7
1.3
203
2
203
2
null
null
null
null
6
P -1
-P 1
2
- C49 H47 Cl11 N6 O12 Zn -
- C49 H47 Cl11 N6 O12 Zn -
- C98 H94 Cl22 N12 O24 Zn2 -
2
1
Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi
Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4059
4066
10.1039/c0dt01617a
0.7107
MoKα
0.0627
0.0499
null
null
0.1204
0.1322
null
null
null
null
null
1.117
null
null
has coordinates
Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4059-4066
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015459.cif $ #-------------------------------------------------------------------...
1,008,657
14.546
0.01
15.211
0.01
9.86
0.006
90
null
105.12
0.04
90
null
2,106.1
null
null
null
null
null
null
null
null
null
5
P 1 21/a 1
-P 2yab
14
Dipotassium tetramanganese cyclo-decaphosphate 18-hydrate
- H36 K2 Mn4 O48 P10 -
- H36 K2 Mn4 O48 P10 -
- H72 K4 Mn8 O96 P20 -
2
0.5
Schuelke, U; Averbuch-Pouchot, M T
Preparation and crystal structure of potassium manganese cyclodecaphosphate octadecahydrate: K~2~Mn~4~P~10~O~30~ . 18H~2~O
Zeitschrift fuer Anorganische und Allgemeine Chemie
1,994
620
545
550
10.1002/zaac.19946200327
null
0.044
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Schuelke, U; Averbuch-Pouchot, M T Preparation and crystal structure of potassium manganese cyclodecaphosphate octadecahydrate: K~2~Mn~4~P~10~O~30~ . 18H~2~O Zeitschrift fuer Anorganische und Allgemeine Chemie 620 (1994) 545-550
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/1/00/86/1008657.cif $ #-------------------------------------------------------------------...
1,008,658
11.896
0.009
12.663
0.007
8.079
0.008
90
null
94.33
0.07
90
null
1,213.5
null
null
null
null
null
null
null
null
null
5
P 1 21 1
P 2yb
4
Dizinc dicaesium cyclo-hexaphosphate octahydrate
- Cs2 H16 O26 P6 Zn2 -
- Cs2 H16 O26 P6 Zn2 -
- Cs4 H32 O52 P12 Zn4 -
2
1
Abid, S; Rzaigui, M; Averbuch-Pouchot, M T
Chemical preparation, structural investigation, and thermal behavior of a new cyclohexaphosphate: Zn~2~Cs~2~P~6~O~18~.8H~2~O
Journal of Solid State Chemistry
1,994
110
180
184
10.1006/jssc.1994.1154
null
0.035
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Abid, S; Rzaigui, M; Averbuch-Pouchot, M T Chemical preparation, structural investigation, and thermal behavior of a new cyclohexaphosphate: Zn~2~Cs~2~P~6~O~18~.8H~2~O Journal of Solid State Chemistry 110 (1994) 180-184
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/1/00/86/1008658.cif $ #-------------------------------------------------------------------...
1,008,659
3.873
0.0003
3.873
0.0003
12.7323
0.0009
90
null
90
null
90
null
191
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Distrontium ruthenium(IV) oxide
- O4 Ru Sr2 -
- O4 Ru Sr2 -
- O8 Ru2 Sr4 -
2
0.0625
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr
Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K
Journal of Solid State Chemistry
1,994
112
355
361
10.1006/jssc.1994.1316
null
0.09
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K Journal of Solid State Chemistry 112 (1994) 355-361
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/1/00/86/1008659.cif $ #-------------------------------------------------------------------...
7,015,458
7.719
0.003
10.624
0.004
12.707
0.004
94.471
0.005
92.306
0.005
97.157
0.005
1,029.5
0.6
173
null
173
null
null
null
null
null
4
P -1
-P 1
2
- C46 H48 N6 O6 -
- C46 H44 N6 O6 -
- C46 H44 N6 O6 -
1
0.5
Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi
Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4059
4066
10.1039/c0dt01617a
0.7107
MoKα
null
0.0541
null
null
null
0.1643
null
null
null
null
null
1.077
null
null
has coordinates
Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4059-4066
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015458.cif $ #-------------------------------------------------------------------...
1,008,660
3.86358
0.00007
3.86358
0.00007
12.7155
0.0004
90
null
90
null
90
null
189.8
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Distrontium ruthenium(IV) oxide
- O4 Ru Sr2 -
- O4 Ru Sr2 -
- O8 Ru2 Sr4 -
2
0.0625
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr
Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K
Journal of Solid State Chemistry
1,994
112
355
361
10.1006/jssc.1994.1316
null
0.089
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K Journal of Solid State Chemistry 112 (1994) 355-361
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/1/00/86/1008660.cif $ #-------------------------------------------------------------------...
1,008,661
5.4994
0.0001
5.4994
0.0001
25.78409
0.0008
90
null
90
null
90
null
779.8
null
null
null
null
null
null
null
null
null
3
I 41/a c d :1
I 4bw 2aw -1bw
142
Distrontium iridium(IV) oxide
- Ir O4 Sr2 -
- Ir O4 Sr2 -
- Ir8 O32 Sr16 -
8
0.25
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr
Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K
Journal of Solid State Chemistry
1,994
112
355
361
10.1006/jssc.1994.1316
null
0.079
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K Journal of Solid State Chemistry 112 (1994) 355-361
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/1/00/86/1008661.cif $ #-------------------------------------------------------------------...
1,008,662
5.48463
0.00009
5.48463
0.00009
25.7977
0.0007
90
null
90
null
90
null
776
null
null
null
null
null
null
null
null
null
3
I 41/a c d :1
I 4bw 2aw -1bw
142
Distrontium iridium(IV) oxide
- Ir O4 Sr2 -
- Ir O4 Sr2 -
- Ir8 O32 Sr16 -
8
0.25
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr
Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K
Journal of Solid State Chemistry
1,994
112
355
361
10.1006/jssc.1994.1316
null
0.079
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Huang, Q; Soubeyroux, J L; Chmaissem, O; Natali Sora, I; Santoro, A; Cava, R J; Krajewski, J J; Peck, W F jr Neutron powder diffraction study of the crystal structures of Sr~2~RuO~4~ and Sr~2~IrO~4~ at room temperature and at 10K Journal of Solid State Chemistry 112 (1994) 355-361
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/1/00/86/1008662.cif $ #-------------------------------------------------------------------...
7,015,457
12.119
0.0006
17.016
0.0009
18.434
0.0009
90
null
95.437
0.002
90
null
3,784.3
0.3
173.1
null
173
2
null
null
null
null
4
C 1 2/c 1
-C 2yc
15
- C46 H44 N6 O4 -
- C46 H44 N6 O4 -
- C184 H176 N24 O16 -
4
0.5
Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi
Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion.
Dalton transactions (Cambridge, England : 2003)
2,011
40
16
4059
4066
10.1039/c0dt01617a
0.7107
MoKα
null
0.0412
null
null
null
0.1112
null
null
null
null
null
1.056
null
null
has coordinates
Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4059-4066
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/7/01/54/7015457.cif $ #-------------------------------------------------------------------...
1,008,663
15.429
0.008
11.794
0.005
14.369
0.009
90
null
115.95
0.05
90
null
2,351.1
null
null
null
null
null
null
null
null
null
4
C 1 2/c 1
-C 2yc
15
Lithium cyclo-hexaphosphate hydrate (6/1/8.2)
- H16.48 Li6 O26.24 P6 -
- H28.716 Li6 O26.238 P6 -
- H114.864 Li24 O104.952 P24 -
4
0.5
Rzaigui, M; Bagieu, M
Synthesis and crystal structure of the lithium cyclohexaphosphate hydrate Li~6~P~6~O~18~ . 9H~2~O
Journal of Solid State Chemistry
1,994
108
11
17
10.1006/jssc.1994.1002
null
0.049
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Rzaigui, M; Bagieu, M Synthesis and crystal structure of the lithium cyclohexaphosphate hydrate Li~6~P~6~O~18~ . 9H~2~O Journal of Solid State Chemistry 108 (1994) 11-17
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/1/00/86/1008663.cif $ #-------------------------------------------------------------------...
1,008,664
7.251
null
7.251
null
6.356
null
90
null
90
null
90
null
334.2
null
null
null
null
null
null
null
null
null
3
I 41/a m d :1
I 4bw 2bw -1bw
141
Samarium(II) chromate
- Cr O4 Sm -
- Cr O4 Sm -
- Cr4 O16 Sm4 -
4
0.125
Buisson, G; Bertaut, F; Mareschal, J
Etude cristallographique des composes T Cr O4 (T= terre rare ou Y)
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965)
1,964
259
411
413
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Buisson, G; Bertaut, F; Mareschal, J Etude cristallographique des composes T Cr O4 (T= terre rare ou Y) Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 259 (1964) 411-413
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/1/00/86/1008664.cif $ #-------------------------------------------------------------------...
1,008,665
3.65447
0.00005
2.86022
0.00003
9.3774
0.0001
90
null
90
null
90
null
98
null
null
null
null
null
null
null
null
null
3
I m m m
-I 2 2
71
Dilithium copper oxide
- Cu Li2 O2 -
- Cu Li2 O2 -
- Cu2 Li4 O4 -
2
0.125
Sapina, F; Rodriguez-Carvajal, J; Sanchis, M J; Ibanez, R; Beltran, A; Beltran, D
Crystal and magnetic structure of Li2 Cu O2
Solid State Communications
1,990
74
779
784
10.1016/0038-1098(90)90934-4
null
0.0313
null
null
null
null
null
null
null
null
null
null
null
1,006,072
null
has coordinates
Sapina, F; Rodriguez-Carvajal, J; Sanchis, M J; Ibanez, R; Beltran, A; Beltran, D Crystal and magnetic structure of Li2 Cu O2 Solid State Communications 74 (1990) 779-784
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/1/00/86/1008665.cif $ #-------------------------------------------------------------------...
1,008,666
3.66153
0.00005
2.86277
0.00002
9.39258
0.00009
90
null
90
null
90
null
98.5
null
null
null
null
null
null
null
null
null
3
I m m m
-I 2 2
71
Dilithium copper oxide
- Cu Li2 O2 -
- Cu Li2 O2 -
- Cu2 Li4 O4 -
2
0.125
Sapina, F; Rodriguez-Carvajal, J; Sanchis, M J; Ibanez, R; Beltran, A; Beltran, D
Crystal and magnetic structure of Li2 Cu O2
Solid State Communications
1,990
74
779
784
10.1016/0038-1098(90)90934-4
null
0.0349
null
null
null
null
null
null
null
null
null
null
null
1,006,073
null
has coordinates
Sapina, F; Rodriguez-Carvajal, J; Sanchis, M J; Ibanez, R; Beltran, A; Beltran, D Crystal and magnetic structure of Li2 Cu O2 Solid State Communications 74 (1990) 779-784
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/1/00/86/1008666.cif $ #-------------------------------------------------------------------...
1,008,667
3.8684
0.0001
3.8684
0.0001
11.6596
0.0003
90
null
90
null
90
null
174.5
null
null
null
null
null
null
null
null
null
5
P 4/m m m
-P 4 2
123
Yttrium barium copper cobalt oxide (1/2/2.7/0.4/7.3)
- Ba2 Co0.345 Cu2.655 O7.29 Y -
- Ba2 Co0.345 Cu2.655 O7.286 Y -
- Ba2 Co0.345 Cu2.655 O7.286 Y -
1
0.0625
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A
Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33
Physica C (Amsterdam) (152,1988-)
1,994
220
143
159
10.1016/0921-4534(94)90895-8
null
0.043
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33 Physica C (Amsterdam) (152,1988-) 220 (1994) 143-159
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/1/00/86/1008667.cif $ #-------------------------------------------------------------------...
1,008,668
3.8865
0.0001
3.8865
0.0001
11.6425
0.0003
90
null
90
null
90
null
175.9
null
null
null
null
null
null
null
null
null
5
P 4/m m m
-P 4 2
123
Yttrium barium copper cobalt oxide (1/2/2.4/0.6/7.3)
- Ba2 Co0.57 Cu2.43 O7.34 Y -
- Ba2 Co0.57 Cu2.43 O7.34 Y -
- Ba2 Co0.57 Cu2.43 O7.34 Y -
1
0.0625
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A
Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33
Physica C (Amsterdam) (152,1988-)
1,994
220
143
159
10.1016/0921-4534(94)90895-8
null
0.045
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33 Physica C (Amsterdam) (152,1988-) 220 (1994) 143-159
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/1/00/86/1008668.cif $ #-------------------------------------------------------------------...
7,015,456
8.6111
0.0017
21.793
0.004
19.306
0.004
90
null
96.29
0.03
90
null
3,601.2
1.2
293
2
293
2
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
- C62 H60 Cl4 Cu2 N10 O19 -
- C62 H60 Cl4 Cu2 N10 O19 -
- C124 H120 Cl8 Cu4 N20 O38 -
2
0.5
Chen, Qiu-Yun; Fu, Hai-Jian; Zhu, Wei-Hua; Qi, Yan; Ma, Zheng-Ping; Zhao, Kai-Di; Gao, Jing
Interaction with DNA and different effect on the nucleus of cancer cells for copper(II) complexes of N-benzyl di(pyridylmethyl)amine.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4414
4420
10.1039/c0dt01616k
0.71073
MoKα
0.0932
0.0782
null
null
0.233
0.25
null
null
null
null
null
1.063
null
null
has coordinates
Chen, Qiu-Yun; Fu, Hai-Jian; Zhu, Wei-Hua; Qi, Yan; Ma, Zheng-Ping; Zhao, Kai-Di; Gao, Jing Interaction with DNA and different effect on the nucleus of cancer cells for copper(II) complexes of N-benzyl di(pyridylmethyl)amine. Dalton transactions (Cambridge, England : 2003) 40(17) (2011) 4414-4420
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/7/01/54/7015456.cif $ #-------------------------------------------------------------------...
1,008,669
3.8772
0.0001
3.8772
0.0001
11.7352
0.0003
90
null
90
null
90
null
176.4
null
null
null
null
null
null
null
null
null
5
P 4/m m m
-P 4 2
123
Yttrium barium copper cobalt oxide (1/2/2.6/0.4/6.9)
- Ba2 Co0.38 Cu2.62 O6.91 Y -
- Ba2 Co0.38 Cu2.62 O6.91 Y -
- Ba2 Co0.38 Cu2.62 O6.91 Y -
1
0.0625
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A
Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33
Physica C (Amsterdam) (152,1988-)
1,994
220
143
159
10.1016/0921-4534(94)90895-8
null
0.044
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33 Physica C (Amsterdam) (152,1988-) 220 (1994) 143-159
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/1/00/86/1008669.cif $ #-------------------------------------------------------------------...
1,008,670
3.885
0.0001
3.885
0.0001
11.7055
0.0003
90
null
90
null
90
null
176.7
null
null
null
null
null
null
null
null
null
5
P 4/m m m
-P 4 2
123
Yttrium barium copper cobalt oxide (1/2/2.4/0.6/7.1)
- Ba2 Co0.554 Cu2.446 O7.12 Y -
- Ba2 Co0.554 Cu2.446 O7.12 Y -
- Ba2 Co0.554 Cu2.446 O7.12 Y -
1
0.0625
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A
Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33
Physica C (Amsterdam) (152,1988-)
1,994
220
143
159
10.1016/0921-4534(94)90895-8
null
0.046
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Renevier, H; Hodeau, J L; Marezio, M; Santoro, A Electron- and powder neutron-diffraction studies of Y Ba2 (Cu1-y Coy)3 O6+x with 0.05< y< 0.33 Physica C (Amsterdam) (152,1988-) 220 (1994) 143-159
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/1/00/86/1008670.cif $ #-------------------------------------------------------------------...
1,008,671
2.921
0.0009
2.921
0.0009
10.459
0.004
90
null
90
null
120
null
77.3
null
null
null
null
null
null
null
null
null
3
P 63/m m c
-P 6c 2c
194
Lithium niobium(III) oxide
- Li Nb O2 -
- Li Nb O2 -
- Li2 Nb2 O4 -
2
0.083333
Bordet, P; Moshopoulou, E; Liesert, S; Capponi, J J
Structure and physical properties of Li(1-x) Nb O2 single crystals
Physica C (Amsterdam) (152,1988-)
1,994
235
745
746
null
0.012
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bordet, P; Moshopoulou, E; Liesert, S; Capponi, J J Structure and physical properties of Li(1-x) Nb O2 single crystals Physica C (Amsterdam) (152,1988-) 235 (1994) 745-746
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/1/00/86/1008671.cif $ #-------------------------------------------------------------------...
1,008,672
2.9239
0.0004
2.9239
0.0004
20.91299
0.002
90
null
90
null
120
null
154.8
null
null
null
null
null
null
null
null
null
3
P -3 m 1
-P 3 2"
164
Lithium niobium oxide (0.8/1/2)
- Li0.795 Nb O2 -
- Li0.795 Nb O2 -
- Li3.18 Nb4 O8 -
4
0.333333
Bordet, P; Moshopoulou, E; Liesert, S; Capponi, J J
Structure and physical properties of Li(1-x) Nb O2 single crystals
Physica C (Amsterdam) (152,1988-)
1,994
235
745
746
null
0.023
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bordet, P; Moshopoulou, E; Liesert, S; Capponi, J J Structure and physical properties of Li(1-x) Nb O2 single crystals Physica C (Amsterdam) (152,1988-) 235 (1994) 745-746
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/1/00/86/1008672.cif $ #-------------------------------------------------------------------...
1,008,673
7.436
0.002
7.436
0.002
7.436
0.002
90
null
90
null
90
null
411.2
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Uranium osmium silicide (2/3.3/0.7)
- Os3.32 Si0.68 U2 -
- Os3.32 Si0.68 U2 -
- Os13.28 Si2.72 U8 -
4
0.020833
Vernière, A.; Lejay, P.; Bordet, P.; Chenavas, J.; Brison, J. P.; Haen, P.; Boucherle, J. X.
Crystal structures and physical properties of some new ternary compounds U2 T3X (T= Ru, Os; X= Si, Ge)
Journal of Alloys and Compounds
1,994
209
1-2
251
255
10.1016/0925-8388(94)91108-8
null
0.049
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Vernière, A.; Lejay, P.; Bordet, P.; Chenavas, J.; Brison, J. P.; Haen, P.; Boucherle, J. X. Crystal structures and physical properties of some new ternary compounds U2 T3X (T= Ru, Os; X= Si, Ge) Journal of Alloys and Compounds 209(1-2) (1994) 251-255
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/1/00/86/1008673.cif $ #-------------------------------------------------------------------...
7,015,455
8.2186
0.0016
18.37
0.004
21.523
0.004
90
null
94.39
0.03
90
null
3,239.9
1.1
293
2
293
2
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
- C31 H31 Cl2 Cu N5 O10 -
- C31 H31 Cl2 Cu N5 O8 -
- C124 H124 Cl8 Cu4 N20 O32 -
4
1
Chen, Qiu-Yun; Fu, Hai-Jian; Zhu, Wei-Hua; Qi, Yan; Ma, Zheng-Ping; Zhao, Kai-Di; Gao, Jing
Interaction with DNA and different effect on the nucleus of cancer cells for copper(II) complexes of N-benzyl di(pyridylmethyl)amine.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4414
4420
10.1039/c0dt01616k
0.71073
MoKα
0.1055
0.0876
null
null
0.2406
0.2572
null
null
null
null
null
1.133
null
null
has coordinates
Chen, Qiu-Yun; Fu, Hai-Jian; Zhu, Wei-Hua; Qi, Yan; Ma, Zheng-Ping; Zhao, Kai-Di; Gao, Jing Interaction with DNA and different effect on the nucleus of cancer cells for copper(II) complexes of N-benzyl di(pyridylmethyl)amine. Dalton transactions (Cambridge, England : 2003) 40(17) (2011) 4414-4420
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015455.cif $ #-------------------------------------------------------------------...
1,008,674
3.86521
0.00007
3.86521
0.00007
15.6486
0.0004
90
null
90
null
90
null
233.8
null
null
null
null
null
null
null
null
null
5
P 4/m m m
-P 4 2
123
Mercury barium calcium copper oxide (0.69/2/2/3/8.6)
- Ba2 Ca2 Cu3 Hg0.692 O8.6 -
- Ba2 Ca2 Cu3 Hg0.692 O8.6 -
- Ba2 Ca2 Cu3 Hg0.692 O8.6 -
1
0.0625
Kopnin, E M; Antipov, E V; Capponi, J J; Bordet, P; Chaillout, C; de Brion, S; Marezio, M; Bobylev, A P; Van Tendeloo, G
Suppression of superconductivity in Hg-1223 and Hg-1234 by partial replacement of Hg by carbon
Physica C (Amsterdam) (152,1988-)
1,995
243
222
232
10.1016/0921-4534(95)00010-0
null
0.084
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Kopnin, E M; Antipov, E V; Capponi, J J; Bordet, P; Chaillout, C; de Brion, S; Marezio, M; Bobylev, A P; Van Tendeloo, G Suppression of superconductivity in Hg-1223 and Hg-1234 by partial replacement of Hg by carbon Physica C (Amsterdam) (152,1988-) 243 (1995) 222-232
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/1/00/86/1008674.cif $ #-------------------------------------------------------------------...
1,008,675
3.8639
0.00004
3.8639
0.00004
9.4771
0.0002
90
null
90
null
90
null
141.5
null
null
null
null
null
null
null
null
null
4
P 4/m m m
-P 4 2
123
Mercury barium copper oxide (0.96/2/1/4.34)
- Ba2 Cu Hg0.96 O4.34 -
- Ba2 Cu Hg0.96 O4.34 -
- Ba2 Cu Hg0.96 O4.34 -
1
0.0625
Alexandre, E T; Loureiro, S M; Antipov, E V; Bordet, P; de Brion, S; Capponi, J J; Marezio, M
On the possibility of replacing Hg by Cu in the Hg Ba2 Cu O(4+d) phase synthesized under high-pressure
Physica C (Amsterdam) (152,1988-)
1,995
245
207
211
10.1016/0921-4534(95)00094-1
null
0.044
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Alexandre, E T; Loureiro, S M; Antipov, E V; Bordet, P; de Brion, S; Capponi, J J; Marezio, M On the possibility of replacing Hg by Cu in the Hg Ba2 Cu O(4+d) phase synthesized under high-pressure Physica C (Amsterdam) (152,1988-) 245 (1995) 207-211
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/1/00/86/1008675.cif $ #-------------------------------------------------------------------...
1,008,676
3.86586
0.00005
3.86586
0.00005
9.4764
0.0003
90
null
90
null
90
null
141.6
null
null
null
null
null
null
null
null
null
4
P 4/m m m
-P 4 2
123
Mercury barium copper oxide (0.98/2/1/4.34)
- Ba2 Cu Hg0.98 O4.34 -
- Ba2 Cu Hg0.98 O4.34 -
- Ba2 Cu Hg0.98 O4.34 -
1
0.0625
Alexandre, E T; Loureiro, S M; Antipov, E V; Bordet, P; de Brion, S; Capponi, J J; Marezio, M
On the possibility of replacing Hg by Cu in the Hg Ba2 Cu O(4+d) phase synthesized under high-pressure
Physica C (Amsterdam) (152,1988-)
1,995
245
207
211
10.1016/0921-4534(95)00094-1
null
0.051
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Alexandre, E T; Loureiro, S M; Antipov, E V; Bordet, P; de Brion, S; Capponi, J J; Marezio, M On the possibility of replacing Hg by Cu in the Hg Ba2 Cu O(4+d) phase synthesized under high-pressure Physica C (Amsterdam) (152,1988-) 245 (1995) 207-211
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/1/00/86/1008676.cif $ #-------------------------------------------------------------------...
1,008,677
5.3204
0.0003
5.3796
0.0003
23.71399
0.001
90
null
90
null
90
null
678.7
null
null
null
null
null
null
null
null
null
5
A m a a
-A 2a 2
66
Bismuth lead distrontium manganese(III) oxide
- Bi Mn O6 Pb Sr2 -
- Bi Mn O6 Pb Sr2 -
- Bi4 Mn4 O24 Pb4 Sr8 -
4
0.25
Levy, D; Fu, W T; Ijdo, D J W; Catti, M
Crystal structure of Bi Pb Sr2 Mn O6 by powder neutron diffraction
Solid State Communications
1,994
92
8
659
663
10.1016/0038-1098(94)90448-0
null
0.0383
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Levy, D; Fu, W T; Ijdo, D J W; Catti, M Crystal structure of Bi Pb Sr2 Mn O6 by powder neutron diffraction Solid State Communications 92(8) (1994) 659-663
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/1/00/86/1008677.cif $ #-------------------------------------------------------------------...
1,008,678
18.84799
0.003
10.918
0.002
3.9153
0.0005
90
null
90
null
90
null
805.7
null
null
null
null
null
null
null
null
null
3
P n m m :2
-P 2c 2bc
59
Erbium iridium silicide (4/13/9)
- Er4 Ir13 Si9 -
- Er4 Ir13 Si9 -
- Er8 Ir26 Si18 -
2
0.25
Verniere, A; Lejay, P; Bordet, P; Chenavas, J; Tholence, J L; Boucherle, J X; Keller, N
Crystal structure and physical properties of new ternary silicides R4 T13 X9 (R, rare earth or uranium; T, rhodium or iridium; X, silicon or germanium)
Journal of Alloys Compd.
1,995
218
197
203
10.1016/0925-8388(94)01400-0
null
0.023
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Verniere, A; Lejay, P; Bordet, P; Chenavas, J; Tholence, J L; Boucherle, J X; Keller, N Crystal structure and physical properties of new ternary silicides R4 T13 X9 (R, rare earth or uranium; T, rhodium or iridium; X, silicon or germanium) Journal of Alloys Compd. 218 (1995) 197-203
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/1/00/86/1008678.cif $ #-------------------------------------------------------------------...
7,015,454
13.0697
0.0004
7.0217
0.0002
20.4319
0.0008
90
null
98.02
0.004
90
null
1,856.73
0.11
173
2
173
2
null
null
null
null
5
I 1 2/a 1
-I 2ya
15
- C14 H24 Fe I2 N2 -
- C14 H24 Fe I2 N2 -
- C56 H96 Fe4 I8 N8 -
4
0.5
Child, Chloe R.; Kealey, Steven; Jones, Harriet; Miller, Philip W.; White, Andrew J. P.; Gee, Anthony D.; Long, Nicholas J.
Binding and photodissociation of CO in iron(ii) complexes for application in positron emission tomography (PET) radiolabelling.
Dalton transactions (Cambridge, England : 2003)
2,011
40
23
6210
6215
10.1039/c0dt01614d
1.54184
CuKα
0.0672
0.0623
null
null
0.1536
0.1584
null
null
null
null
null
1.094
null
null
has coordinates
Child, Chloe R.; Kealey, Steven; Jones, Harriet; Miller, Philip W.; White, Andrew J. P.; Gee, Anthony D.; Long, Nicholas J. Binding and photodissociation of CO in iron(ii) complexes for application in positron emission tomography (PET) radiolabelling. Dalton transactions (Cambridge, England : 2003) 40(23) (2011) 6210-6...
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015454.cif $ #-------------------------------------------------------------------...
1,008,679
7.1838
0.0002
9.7373
0.0003
5.6018
0.0002
90
null
90
null
90
null
391.9
null
null
null
null
null
null
null
null
null
3
I m m a
-I 2b 2
74
Cerium iridium silicide (1/3/2)
- Ce Ir3 Si2 -
- Ce Ir3 Si2 -
- Ce4 Ir12 Si8 -
4
0.25
Verniere, A; Lejay, P; Bordet, P; Chenavas, J; Tholence, J L; Boucherle, J X; Keller, N
Crystal structure and physical properties of new ternary silicides R4 T13 X9 (R, rare earth or uranium; T, rhodium or iridium; X, silicon or germanium)
Journal of Alloys Compd.
1,995
218
197
203
10.1016/0925-8388(94)01400-0
null
0.089
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Verniere, A; Lejay, P; Bordet, P; Chenavas, J; Tholence, J L; Boucherle, J X; Keller, N Crystal structure and physical properties of new ternary silicides R4 T13 X9 (R, rare earth or uranium; T, rhodium or iridium; X, silicon or germanium) Journal of Alloys Compd. 218 (1995) 197-203
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/1/00/86/1008679.cif $ #-------------------------------------------------------------------...
1,008,680
5.381
0.003
5.381
0.003
8.798
0.006
90
null
90
null
120
null
220.6
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium chromium manganese deuteride (1/1.8/0.2/2.46)
- Cr1.8 D2.46 Mn0.2 Zr -
- Cr1.8 D2.46 Mn0.2 Zr -
- Cr7.2 D9.84 Mn0.8 Zr4 -
4
0.166667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.051
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008680.cif $ #-------------------------------------------------------------------...
1,008,681
5.374
0.002
5.374
0.002
8.784
0.004
90
null
90
null
120
null
219.7
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium chromium iron deuteride (1/1.8/0.2/3.66)
- Cr1.8 D3.66 Fe0.2 Zr -
- Cr1.8 D3.66 Fe0.2 Zr -
- Cr7.2 D14.64 Fe0.8 Zr4 -
4
0.166667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.049
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008681.cif $ #-------------------------------------------------------------------...
1,008,682
5.37
0.002
5.37
0.002
8.789
0.003
90
null
90
null
120
null
219.5
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium chromium cobalt deuteride (1/1.8/0.2/3.62)
- Co0.2 Cr1.8 D3.615 Zr -
- Co0.2 Cr1.8 D3.615 Zr -
- Co0.8 Cr7.2 D14.46 Zr4 -
4
0.166667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.04
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008682.cif $ #-------------------------------------------------------------------...
7,015,453
29.431
0.003
8.9496
0.001
16.2751
0.0018
90
null
115.307
0.002
90
null
3,875.4
0.7
110
2
110
2
null
null
null
null
7
C 1 2/c 1
-C 2yc
15
- C41 H32 Cl2 Cu2 O P2 S2 -
- C41 H32 Cl2 Cu2 O P2 S2 -
- C164 H128 Cl8 Cu8 O4 P8 S8 -
4
0.5
Jarvis, Amanda G.; Whitwood, Adrian C.; Fairlamb, Ian J. S.
Cu(I) complexes containing a multidentate and conformationally flexible dibenzylidene acetone ligand (dbathiophos): application in catalytic alkene cyclopropanation.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3695
3702
10.1039/c0dt01612h
0.71073
MoKα
0.088
0.0423
null
null
0.0954
0.1134
null
null
null
null
null
1.016
null
null
has coordinates
Jarvis, Amanda G.; Whitwood, Adrian C.; Fairlamb, Ian J. S. Cu(I) complexes containing a multidentate and conformationally flexible dibenzylidene acetone ligand (dbathiophos): application in catalytic alkene cyclopropanation. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3695-3702
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015453.cif $ #-------------------------------------------------------------------...
1,008,683
5.367
0.002
5.367
0.002
8.793
0.003
90
null
90
null
120
null
219.3
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium chromium nickel deuteride (1/1.8/0.2/3.53)
- Cr1.8 D3.525 Ni0.2 Zr -
- Cr1.8 D3.525 Ni0.2 Zr -
- Cr7.2 D14.1 Ni0.8 Zr4 -
4
0.166667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.032
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008683.cif $ #-------------------------------------------------------------------...
1,008,684
5.357
0.002
5.357
0.002
8.722
0.003
90
null
90
null
120
null
216.8
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium chromium copper deuteride (1/1.8/0.2/3.68)
- Cr1.8 Cu0.2 D3.684 Zr -
- Cr1.8 Cu0.2 D3.684 Zr -
- Cr7.2 Cu0.8 D14.736 Zr4 -
4
0.166667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.023
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008684.cif $ #-------------------------------------------------------------------...
1,008,685
7.68
0.002
7.68
0.002
7.68
0.002
90
null
90
null
90
null
453
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Zirconium chromium deuteride (1/2/3.51)
- Cr2 D3.51 Zr -
- Cr2 D3.51 Zr -
- Cr16 D28.08 Zr8 -
8
0.041667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.041
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008685.cif $ #-------------------------------------------------------------------...
1,008,686
7.754
0.002
7.754
0.002
7.754
0.002
90
null
90
null
90
null
466.2
null
null
null
null
null
null
null
null
null
4
F d -3 m :2
-F 4vw 2vw 3
227
Zirconium chromium manganese deuteride (1/1.8/0.2/3.80)
- Cr1.8 D3.8 Mn0.2 Zr -
- Cr1.8 D3.7996 Mn0.2 Zr -
- Cr14.4 D30.3968 Mn1.6 Zr8 -
8
0.041667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.037
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008686.cif $ #-------------------------------------------------------------------...
7,015,452
25.838
0.003
25.365
0.003
14.722
0.0015
90
null
97.563
0.002
90
null
9,564.6
1.9
110
2
110
2
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
- C82 H64 Cu2 F12 O4 P6 S4 -
- C82 H64 Cu2 F12 O4 P6 S4 -
- C328 H256 Cu8 F48 O16 P24 S16 -
4
1
Jarvis, Amanda G.; Whitwood, Adrian C.; Fairlamb, Ian J. S.
Cu(I) complexes containing a multidentate and conformationally flexible dibenzylidene acetone ligand (dbathiophos): application in catalytic alkene cyclopropanation.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3695
3702
10.1039/c0dt01612h
0.71073
MoKα
0.1422
0.0828
null
null
0.1993
0.2117
null
null
null
null
null
1.143
null
null
has coordinates
Jarvis, Amanda G.; Whitwood, Adrian C.; Fairlamb, Ian J. S. Cu(I) complexes containing a multidentate and conformationally flexible dibenzylidene acetone ligand (dbathiophos): application in catalytic alkene cyclopropanation. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3695-3702
179,858
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:41:51 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179858 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015452.cif $ #-------------------------------------------------------------------...
1,008,687
7.6551
0.0008
7.6551
0.0008
7.6551
0.0008
90
null
90
null
90
null
448.6
null
null
null
null
null
null
null
null
null
4
F d -3 m :2
-F 4vw 2vw 3
227
Zirconium chromium iron deuteride (1/1.8/0.2/3.65)
- Cr1.8 D3.65 Fe0.2 Zr -
- Cr1.8 D3.6504 Fe0.2 Zr -
- Cr14.4 D29.2032 Fe1.6 Zr8 -
8
0.041667
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L
Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides
Journal of Alloys Compd.
1,995
219
48
54
10.1016/0925-8388(94)05019-8
null
0.028
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Bououdina, M; Fruchart, D; Pontonnier, L Phase stability and neutron diffraction studies of Laves phases Zr (Cr1- x Mx)2 with M =Mn,Fe,Co,Ni,Cu and 0 < x <0.2 and their hydrides Journal of Alloys Compd. 219 (1995) 48-54
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/1/00/86/1008687.cif $ #-------------------------------------------------------------------...