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a
float64
siga
float64
b
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sigb
float64
c
float64
sigc
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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
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1,008,523
14.425
0.004
7.571
0.003
6.42
0.003
90
null
90
null
90
null
701.1
null
null
null
null
null
null
null
null
null
3
I b a m
-I 2 2c
72
Dicaesium catena-diarsenidosilicate
- As2 Cs2 Si -
- As2 Cs2 Si -
- As8 Cs8 Si4 -
4
0.25
Eisenmann, B; Klein, J
SiS~2~-isostrukturelle Anionen (SiP~2~^2-^),(GeAs~2~^2-^) und (SnAs~2~^2-^) in Alkaliverbindungen
Journal of the Less-Common Metals
1,991
175
109
117
10.1016/0022-5088(91)90355-8
null
0.075
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Eisenmann, B; Klein, J SiS~2~-isostrukturelle Anionen (SiP~2~^2-^),(GeAs~2~^2-^) und (SnAs~2~^2-^) in Alkaliverbindungen Journal of the Less-Common Metals 175 (1991) 109-117
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/1/00/85/1008523.cif $ #-------------------------------------------------------------------...
1,008,524
14.657
0.004
7.733
0.003
6.953
0.003
90
null
90
null
90
null
788.1
null
null
null
null
null
null
null
null
null
3
I b a m
-I 2 2c
72
Dicaesium catena-diarsenidostannate
- As2 Cs2 Sn -
- As2 Cs2 Sn -
- As8 Cs8 Sn4 -
4
0.25
Eisenmann, B; Klein, J
SiS~2~-isostrukturelle Anionen (SiP~2~^2-^),(GeAs~2~^2-^) und (SnAs~2~^2-^) in Alkaliverbindungen
Journal of the Less-Common Metals
1,991
175
109
117
10.1016/0022-5088(91)90355-8
null
0.048
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Eisenmann, B; Klein, J SiS~2~-isostrukturelle Anionen (SiP~2~^2-^),(GeAs~2~^2-^) und (SnAs~2~^2-^) in Alkaliverbindungen Journal of the Less-Common Metals 175 (1991) 109-117
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/1/00/85/1008524.cif $ #-------------------------------------------------------------------...
1,008,525
14.323
0.003
7.106
0.002
15.795
0.003
90
null
90.3
0.02
90
null
1,607.6
null
null
null
null
null
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
Tetrapotassium phyllo-hexaarsenidotetraindate
- As6 In4 K4 -
- As6 In4 K4 -
- As24 In16 K16 -
4
1
Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J
Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb
Journal of Materials Chemistry
1,991
1
4
555
558
10.1039/jm9910100555
null
0.035
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb Journal of Materials Chemistry 1(4) (1991) 555-558
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/1/00/85/1008525.cif $ #-------------------------------------------------------------------...
1,008,526
15.288
0.005
7.544
0.001
16.79
0.003
90
null
90.54
0.02
90
null
1,936.3
null
null
null
null
null
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
Tetrapotassium phyllo-hexaantimonidotetraindate
- In4 K4 Sb6 -
- In4 K4 Sb6 -
- In16 K16 Sb24 -
4
1
Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J
Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb
Journal of Materials Chemistry
1,991
1
4
555
558
10.1039/jm9910100555
null
0.042
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb Journal of Materials Chemistry 1(4) (1991) 555-558
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/1/00/85/1008526.cif $ #-------------------------------------------------------------------...
1,008,527
5.736
0.002
4.892
0.001
5.748
0.002
90
null
108.07
0.02
90
null
153.3
null
null
null
null
null
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
Sodium tetrafluoromanganate(III)
- F4 Mn Na -
- F4 Mn Na -
- F8 Mn2 Na2 -
2
0.5
Molinier, M; Massa, W; Khairoun, S; Tressaud, A; Soubeyroux, J L
Crystal and magnetic structures of NaMnF~4~
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)
1,991
46
12
1669
1673
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Molinier, M; Massa, W; Khairoun, S; Tressaud, A; Soubeyroux, J L Crystal and magnetic structures of NaMnF~4~ Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 46(12) (1991) 1669-1673
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/1/00/85/1008527.cif $ #-------------------------------------------------------------------...
1,008,528
5.755
0.002
4.892
0.001
5.76
0.002
90
null
108.62
0.01
90
null
153.7
null
null
null
null
null
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
Sodium tetrafluoromanganate(III)
- F4 Mn Na -
- F4 Mn Na -
- F8 Mn2 Na2 -
2
0.5
Molinier, M; Massa, W; Khairoun, S; Tressaud, A; Soubeyroux, J L
Crystal and magnetic structures of NaMnF~4~
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)
1,991
46
12
1669
1673
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Molinier, M; Massa, W; Khairoun, S; Tressaud, A; Soubeyroux, J L Crystal and magnetic structures of NaMnF~4~ Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 46(12) (1991) 1669-1673
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/1/00/85/1008528.cif $ #-------------------------------------------------------------------...
1,008,529
8.775
0.001
8.775
0.001
12.641
0.001
90
null
90
null
120
null
843
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Praseodymium iron nitride (2/17/2.9)
- Fe17 N2.92 Pr2 -
- Fe17 N2.919 Pr2 -
- Fe51 N8.757 Pr6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Pannetier, J
Neutron powder diffraction study of Pr~2~Fe~17~ and Pr~2~Fe~17~N~2.9~
Physical Review, Serie 3. B - Condensed Matter (18,1978-)
1,992
45
2920
2926
10.1103/PhysRevB.45.2920
null
0.04
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Pannetier, J Neutron powder diffraction study of Pr~2~Fe~17~ and Pr~2~Fe~17~N~2.9~ Physical Review, Serie 3. B - Condensed Matter (18,1978-) 45 (1992) 2920-2926
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/1/00/85/1008529.cif $ #-------------------------------------------------------------------...
7,015,486
7.392
0.006
24.362
0.019
9.914
0.008
90
null
102.872
0.01
90
null
1,740
2
110
2
110
2
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
- C14 H18 Cl2 Cu N4 O2 S -
- C14 H18 Cl2 Cu N4 O2 S -
- C56 H72 Cl8 Cu4 N16 O8 S4 -
4
1
Raja, Duraisamy Senthil; Paramaguru, Ganesan; Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.; Renganathan, Rajalingam; Natarajan, Karuppannan
Effect of terminal N-substitution in 2-oxo-1,2-dihydroquinoline-3-carbaldehyde thiosemicarbazones on the mode of coordination, structure, interaction with protein, radical scavenging and cytotoxic activity of copper(II) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4548
4559
10.1039/c0dt01657h
0.71073
MoKα
0.0472
0.0334
null
null
0.0799
0.0853
null
null
null
null
null
1.021
null
null
has coordinates
Raja, Duraisamy Senthil; Paramaguru, Ganesan; Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.; Renganathan, Rajalingam; Natarajan, Karuppannan Effect of terminal N-substitution in 2-oxo-1,2-dihydroquinoline-3-carbaldehyde thiosemicarbazones on the mode of coordination, structure, interaction with protein, radical sca...
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/7/01/54/7015486.cif $ #-------------------------------------------------------------------...
1,008,530
8.771
0.001
8.771
0.001
12.629
0.001
90
null
90
null
120
null
841.4
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Praseodymium iron nitride (2/17/2.9)
- Fe17 N2.92 Pr2 -
- Fe17 N2.919 Pr2 -
- Fe51 N8.757 Pr6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Pannetier, J
Neutron powder diffraction study of Pr~2~Fe~17~ and Pr~2~Fe~17~N~2.9~
Physical Review, Serie 3. B - Condensed Matter (18,1978-)
1,992
45
2920
2926
10.1103/PhysRevB.45.2920
null
0.01
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Pannetier, J Neutron powder diffraction study of Pr~2~Fe~17~ and Pr~2~Fe~17~N~2.9~ Physical Review, Serie 3. B - Condensed Matter (18,1978-) 45 (1992) 2920-2926
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/1/00/85/1008530.cif $ #-------------------------------------------------------------------...
1,008,531
8.817
0.001
8.817
0.001
12.692
0.001
90
null
90
null
120
null
854.5
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Praseodymium iron nitride (2/17/2.9)
- Fe17 N2.92 Pr2 -
- Fe17 N2.919 Pr2 -
- Fe51 N8.757 Pr6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Pannetier, J
Neutron powder diffraction study of Pr~2~Fe~17~ and Pr~2~Fe~17~N~2.9~
Physical Review, Serie 3. B - Condensed Matter (18,1978-)
1,992
45
2920
2926
10.1103/PhysRevB.45.2920
null
0.044
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Pannetier, J Neutron powder diffraction study of Pr~2~Fe~17~ and Pr~2~Fe~17~N~2.9~ Physical Review, Serie 3. B - Condensed Matter (18,1978-) 45 (1992) 2920-2926
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/1/00/85/1008531.cif $ #-------------------------------------------------------------------...
1,008,532
9.688
0.002
8.002
0.001
8.339
0.001
90
null
90
null
90
null
646.5
null
null
null
null
null
null
null
null
null
5
C m c m
-C 2c 2
63
Dithallium catena-pentafluoromanganate(III) hydrate
- F5 H2 Mn O Tl2 -
- F5 H4 Mn O Tl2 -
- F20 H16 Mn4 O4 Tl8 -
4
0.25
Nunez, P; Tressaud, A; Darriet, J; Hagenmuller, P; Hahn, G; Frenzen, G; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L
A new linear chain compound: crystal and magnetic structures of Tl~2~MnF~5~.H~2~O
Inorganic Chemistry
1,992
31
770
774
10.1021/ic00031a015
null
0.034
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Nunez, P; Tressaud, A; Darriet, J; Hagenmuller, P; Hahn, G; Frenzen, G; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L A new linear chain compound: crystal and magnetic structures of Tl~2~MnF~5~.H~2~O Inorganic Chemistry 31 (1992) 770-774
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/1/00/85/1008532.cif $ #-------------------------------------------------------------------...
1,008,533
9.526
0.002
7.861
0.001
8.317
0.001
90
null
90
null
90
null
622.8
null
null
null
null
null
null
null
null
null
5
C m c m
-C 2c 2
63
Dithallium catena-pentafluoromanganate(III) hydrate
- F5 H2 Mn O Tl2 -
- F5 H4 Mn O Tl2 -
- F20 H16 Mn4 O4 Tl8 -
4
0.25
Nunez, P; Tressaud, A; Darriet, J; Hagenmuller, P; Hahn, G; Frenzen, G; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L
A new linear chain compound: crystal and magnetic structures of Tl~2~MnF~5~.H~2~O
Inorganic Chemistry
1,992
31
770
774
10.1021/ic00031a015
null
0.034
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Nunez, P; Tressaud, A; Darriet, J; Hagenmuller, P; Hahn, G; Frenzen, G; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L A new linear chain compound: crystal and magnetic structures of Tl~2~MnF~5~.H~2~O Inorganic Chemistry 31 (1992) 770-774
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/1/00/85/1008533.cif $ #-------------------------------------------------------------------...
1,008,534
7.6827
0.0004
7.6827
0.0004
7.6827
0.0004
90
null
90
null
90
null
453.5
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Iron zirconium fluoride (0.8/0.2/3.2)
- F3.2 Fe0.8 Zr0.2 -
- F3.2004 Fe0.8 Zr0.2 -
- F76.8096 Fe19.2 Zr4.8 -
24
0.125
Ruchaud, N; Grannec, J; Hagenmuller, P; Soubeyroux, J L
A neutron diffraction study of the anion-excess cubic ReO~3~-type derived phase Fe~.8~Zr~.2~F~3.2~
Journal of Alloys Compd.
1,992
183
263
270
10.1016/0925-8388(92)90750-4
null
0.015
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ruchaud, N; Grannec, J; Hagenmuller, P; Soubeyroux, J L A neutron diffraction study of the anion-excess cubic ReO~3~-type derived phase Fe~.8~Zr~.2~F~3.2~ Journal of Alloys Compd. 183 (1992) 263-270
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/1/00/85/1008534.cif $ #-------------------------------------------------------------------...
1,008,535
5.952
0.001
8.543
0.001
5.949
0.001
90
null
90
null
90
null
302.5
null
null
null
null
null
null
null
null
null
4
P n m a
-P 2ac 2n
62
Ammonium manganese fluoride
- F3 H4 Mn N -
- F3 H2 Mn N -
- F12 H8 Mn4 N4 -
4
0.5
Laguna, M A; Sanjuan, M L; Orera, V M; Rubin, J; Palacios, E; Pique, M C; Bartolome, J; Berar, J F
X-ray and raman study of the low temperature NH~4~MnF~3~ structure;evidence of librational motion of the NH~4~^+^ ion
Journal of Physics: Condensed Matter
1,993
5
283
300
10.1088/0953-8984/5/3/005
null
0.059
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Laguna, M A; Sanjuan, M L; Orera, V M; Rubin, J; Palacios, E; Pique, M C; Bartolome, J; Berar, J F X-ray and raman study of the low temperature NH~4~MnF~3~ structure;evidence of librational motion of the NH~4~^+^ ion Journal of Physics: Condensed Matter 5 (1993) 283-300
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/1/00/85/1008535.cif $ #-------------------------------------------------------------------...
7,015,485
12.487
0.0005
10.0729
0.0004
12.6494
0.0005
90
null
101.165
0.001
90
null
1,560.93
0.11
110
2
110
2
null
null
null
null
7
P 1 21/n 1
-P 2yn
14
- C11 H13.8 Cl2 Cu N4 O2.9 S -
- C11 H13.8 Cl2 Cu N4 O2.9 S -
- C44 H55.2 Cl8 Cu4 N16 O11.6 S4 -
4
1
Raja, Duraisamy Senthil; Paramaguru, Ganesan; Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.; Renganathan, Rajalingam; Natarajan, Karuppannan
Effect of terminal N-substitution in 2-oxo-1,2-dihydroquinoline-3-carbaldehyde thiosemicarbazones on the mode of coordination, structure, interaction with protein, radical scavenging and cytotoxic activity of copper(II) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4548
4559
10.1039/c0dt01657h
1.54178
CuKα
0.0293
0.0268
null
null
0.0683
0.0694
null
null
null
null
null
1.06
null
null
has coordinates
Raja, Duraisamy Senthil; Paramaguru, Ganesan; Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.; Renganathan, Rajalingam; Natarajan, Karuppannan Effect of terminal N-substitution in 2-oxo-1,2-dihydroquinoline-3-carbaldehyde thiosemicarbazones on the mode of coordination, structure, interaction with protein, radical sca...
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/7/01/54/7015485.cif $ #-------------------------------------------------------------------...
1,008,536
7.002
0.002
8.3516
0.002
10.9052
0.0023
91.91
0.02
108.39
0.02
110.5
0.02
559.4
null
null
null
null
null
null
null
null
null
2
B -1
-P 1 (-1/2*x+1/2*z,-y,1/2*x+1/2*z)
2
Vanadium oxide (5/9)
- O9 V5 -
- O9 V5 -
- O36 V20 -
4
null
Le Page, Y; Bordet, P; Marezio, M
Valence ordering in V~5~O~9~ below 120K
Journal of Solid State Chemistry
1,991
92
380
385
10.1016/0022-4596(91)90346-J
null
0.028
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Le Page, Y; Bordet, P; Marezio, M Valence ordering in V~5~O~9~ below 120K Journal of Solid State Chemistry 92 (1991) 380-385
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/1/00/85/1008536.cif $ #-------------------------------------------------------------------...
1,008,537
4.874
0.008
4.874
0.008
8.515
0.02
90
null
90
null
120
null
175.2
null
null
null
null
null
null
null
null
null
2
P 63/m m c
-P 6c 2c
194
Sodium arsenide - $-alpha
- As Na3 -
- As Na3 -
- As2 Na6 -
2
0.083333
Beister, H J; Syassen, K; Klein, J
Phase transition of Na~3~As under pressure
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)
1,990
45
1388
1392
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Beister, H J; Syassen, K; Klein, J Phase transition of Na~3~As under pressure Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 45 (1990) 1388-1392
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$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/1/00/85/1008537.cif $ #-------------------------------------------------------------------...
1,008,538
6.835
0.015
6.835
0.015
6.835
0.015
90
null
90
null
90
null
319.3
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Sodium arsenide - $-beta
- As Na3 -
- As Na3 -
- As4 Na12 -
4
0.020833
Beister, H J; Syassen, K; Klein, J
Phase transition of Na~3~As under pressure
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)
1,990
45
1388
1392
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Beister, H J; Syassen, K; Klein, J Phase transition of Na~3~As under pressure Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 45 (1990) 1388-1392
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$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/1/00/85/1008538.cif $ #-------------------------------------------------------------------...
1,008,539
3.8666
0.0006
3.7281
0.0009
12.644
0.001
90
null
90
null
90
null
182.3
null
null
null
null
null
null
null
null
null
4
I m m m
-I 2 2
71
Lanthanum strontium nickel oxide (1/1/1/3.4)
- La Ni O3.43 Sr -
- La Ni O3.43 Sr -
- La2 Ni2 O6.86 Sr2 -
2
0.125
Crespin, M; Landron, C; Odier, P; Bassat, J M; Mouron, P; Choisnet, J
Evidence for nickel-(I)-rich mixed oxide with a defect K~2~NiF~4~ type structure
Journal of Solid State Chemistry
1,992
100
281
291
10.1016/0022-4596(92)90102-2
null
0.036
null
null
null
null
null
null
null
null
null
null
null
1,001,513
null
has coordinates
Crespin, M; Landron, C; Odier, P; Bassat, J M; Mouron, P; Choisnet, J Evidence for nickel-(I)-rich mixed oxide with a defect K~2~NiF~4~ type structure Journal of Solid State Chemistry 100 (1992) 281-291
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/1/00/85/1008539.cif $ #-------------------------------------------------------------------...
1,008,540
3.853
0.002
3.566
0.003
12.869
0.011
90
null
90
null
90
null
176.8
null
null
null
null
null
null
null
null
null
4
I m m m
-I 2 2
71
Lanthanum strontium nickel oxide (1/1/1/3.1)
- La Ni O3.09 Sr -
- La Ni O3.09 Sr -
- La2 Ni2 O6.18 Sr2 -
2
0.125
Crespin, M; Landron, C; Odier, P; Bassat, J M; Mouron, P; Choisnet, J
Evidence for nickel-(I)-rich mixed oxide with a defect K~2~NiF~4~ type structure
Journal of Solid State Chemistry
1,992
100
281
291
10.1016/0022-4596(92)90102-2
null
0.058
null
null
null
null
null
null
null
null
null
null
null
1,001,514
null
has coordinates
Crespin, M; Landron, C; Odier, P; Bassat, J M; Mouron, P; Choisnet, J Evidence for nickel-(I)-rich mixed oxide with a defect K~2~NiF~4~ type structure Journal of Solid State Chemistry 100 (1992) 281-291
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/1/00/85/1008540.cif $ #-------------------------------------------------------------------...
1,008,541
5.352
null
5.4
null
13.157
null
90
null
90
null
90
null
380.2
null
null
null
null
null
null
null
null
null
3
B m a b
-B 2ab 2
64
Dilanthanum copper oxide
- Cu La2 O4 -
- Cu La2 O4 -
- Cu4 La8 O16 -
4
null
Tuilier, M H; Chevalier, B; Tressaud, A; Brisson, C; Soubeyroux, J L; Etourneau, J
EXAFS study at the LaL~III~ X-ray absorption edge of superconducting materials obtained by fluorination of La~2-x~Sr~x~CuO~4~ oxides (0<x<0.15)
Physica C (Amsterdam) (152,1988-)
1,992
200
113
121
10.1016/0921-4534(92)90327-9
null
0.04
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Tuilier, M H; Chevalier, B; Tressaud, A; Brisson, C; Soubeyroux, J L; Etourneau, J EXAFS study at the LaL~III~ X-ray absorption edge of superconducting materials obtained by fluorination of La~2-x~Sr~x~CuO~4~ oxides (0<x<0.15) Physica C (Amsterdam) (152,1988-) 200 (1992) 113-121
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/1/00/85/1008541.cif $ #-------------------------------------------------------------------...
1,008,542
5.328
null
5.427
null
13.194
null
90
null
90
null
90
null
381.5
null
null
null
null
null
null
null
null
null
3
B m a b
-B 2ab 2
64
Lanthanum copper oxide (2/1/4.2)
- Cu La2 O4.178 -
- Cu La2 O4.178 -
- Cu4 La8 O16.712 -
4
null
Tuilier, M H; Chevalier, B; Tressaud, A; Brisson, C; Soubeyroux, J L; Etourneau, J
EXAFS study at the LaL~III~ X-ray absorption edge of superconducting materials obtained by fluorination of La~2-x~Sr~x~CuO~4~ oxides (0<x<0.15)
Physica C (Amsterdam) (152,1988-)
1,992
200
113
121
10.1016/0921-4534(92)90327-9
null
0.102
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Tuilier, M H; Chevalier, B; Tressaud, A; Brisson, C; Soubeyroux, J L; Etourneau, J EXAFS study at the LaL~III~ X-ray absorption edge of superconducting materials obtained by fluorination of La~2-x~Sr~x~CuO~4~ oxides (0<x<0.15) Physica C (Amsterdam) (152,1988-) 200 (1992) 113-121
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/1/00/85/1008542.cif $ #-------------------------------------------------------------------...
7,015,484
11.042
0.005
10.058
0.005
15.258
0.007
90
null
107.627
0.006
90
null
1,615
1.3
110
2
110
2
null
null
null
null
7
P 1 21/n 1
-P 2yn
14
- C12 H15 Cl2 Cu N4 O2.5 S -
- C12 H15 Cl2 Cu N4 O2.5 S -
- C48 H60 Cl8 Cu4 N16 O10 S4 -
4
1
Raja, Duraisamy Senthil; Paramaguru, Ganesan; Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.; Renganathan, Rajalingam; Natarajan, Karuppannan
Effect of terminal N-substitution in 2-oxo-1,2-dihydroquinoline-3-carbaldehyde thiosemicarbazones on the mode of coordination, structure, interaction with protein, radical scavenging and cytotoxic activity of copper(II) complexes.
Dalton transactions (Cambridge, England : 2003)
2,011
40
17
4548
4559
10.1039/c0dt01657h
0.71073
MoKα
0.0628
0.0485
null
null
0.1277
0.1368
null
null
null
null
null
1.037
null
null
has coordinates
Raja, Duraisamy Senthil; Paramaguru, Ganesan; Bhuvanesh, Nattamai S. P.; Reibenspies, Joseph H.; Renganathan, Rajalingam; Natarajan, Karuppannan Effect of terminal N-substitution in 2-oxo-1,2-dihydroquinoline-3-carbaldehyde thiosemicarbazones on the mode of coordination, structure, interaction with protein, radical sca...
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/7/01/54/7015484.cif $ #-------------------------------------------------------------------...
1,008,543
8.7449
0.0003
8.7449
0.0013
21.819
0.001
90
null
90
null
120
null
1,445
null
null
null
null
null
null
null
null
null
5
R -3 c :H
-R 3 2"c
167
Dicopper(I) chromium zirconium tris(phosphate)
- Cr Cu2 O12 P3 Zr -
- Cr Cu1.9998 O12 P3 Zr -
- Cr6 Cu11.9988 O72 P18 Zr6 -
6
0.166667
Boireau, A; Soubeyroux, J L; Gravereau, P; Olazcuaga, R; Le Flem, G
Evidence of copper pairing in Cu~2~^I^CrZr(PO4/4)~3~, a crystallographic study
European Journal of Solid State Inorganic Chemistry
1,993
30
337
346
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Boireau, A; Soubeyroux, J L; Gravereau, P; Olazcuaga, R; Le Flem, G Evidence of copper pairing in Cu~2~^I^CrZr(PO4/4)~3~, a crystallographic study European Journal of Solid State Inorganic Chemistry 30 (1993) 337-346
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/1/00/85/1008543.cif $ #-------------------------------------------------------------------...
1,008,544
4.02
0.003
4.02
0.003
10.548
0.007
90
null
90
null
90
null
170.5
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Praseodymium manganese silicide (1/2/2)
- Mn2 Pr Si2 -
- Mn2 Pr Si2 -
- Mn4 Pr2 Si4 -
2
0.0625
Welter, R; Venturini, G; Fruchart, D; Malaman, B
Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies
Journal of Alloys Compd.
1,993
191
263
270
10.1016/0925-8388(93)90075-X
null
0.017
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Welter, R; Venturini, G; Fruchart, D; Malaman, B Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies Journal of Alloys Compd. 191 (1993) 263-270
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/1/00/85/1008544.cif $ #-------------------------------------------------------------------...
1,008,545
4.019
0.003
4.019
0.003
10.551
0.007
90
null
90
null
90
null
170.4
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Praseodymium manganese silicide (1/2/2)
- Mn2 Pr Si2 -
- Mn2 Pr Si2 -
- Mn4 Pr2 Si4 -
2
0.0625
Welter, R; Venturini, G; Fruchart, D; Malaman, B
Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies
Journal of Alloys Compd.
1,993
191
263
270
10.1016/0925-8388(93)90075-X
null
0.015
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Welter, R; Venturini, G; Fruchart, D; Malaman, B Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies Journal of Alloys Compd. 191 (1993) 263-270
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/1/00/85/1008545.cif $ #-------------------------------------------------------------------...
1,008,546
3.998
0.003
3.998
0.003
10.51
0.007
90
null
90
null
90
null
168
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Neodymium manganese silicide (1/2/2)
- Mn2 Nd Si2 -
- Mn2 Nd Si2 -
- Mn4 Nd2 Si4 -
2
0.0625
Welter, R; Venturini, G; Fruchart, D; Malaman, B
Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies
Journal of Alloys Compd.
1,993
191
263
270
10.1016/0925-8388(93)90075-X
null
0.015
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Welter, R; Venturini, G; Fruchart, D; Malaman, B Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies Journal of Alloys Compd. 191 (1993) 263-270
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/1/00/85/1008546.cif $ #-------------------------------------------------------------------...
7,015,483
13.239
0.005
13.699
0.005
16.251
0.005
72.13
0.005
68.38
0.005
68.57
0.005
2,499.5
1.5
153
2
153
2
null
null
null
null
5
P -1
-P 1
2
- C62.5 H42 Cl2 N6 Zn -
- C62 H41 Cl N6 Zn -
- C124 H82 Cl2 N12 Zn2 -
2
1
Gresser, Roland; Hoyer, Alexander; Hummert, Markus; Hartmann, Horst; Leo, Karl; Riede, Moritz
Homoleptic Co(II), Ni(II), Cu(II), Zn(II) and Hg(II) complexes of bis-(phenyl)-diisoindol-aza-methene.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3476
3483
10.1039/c0dt01655a
0.71069
MoKα
0.0807
0.0606
null
null
0.1484
0.1598
null
null
null
null
null
1.079
null
null
has coordinates
Gresser, Roland; Hoyer, Alexander; Hummert, Markus; Hartmann, Horst; Leo, Karl; Riede, Moritz Homoleptic Co(II), Ni(II), Cu(II), Zn(II) and Hg(II) complexes of bis-(phenyl)-diisoindol-aza-methene. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3476-3483
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/7/01/54/7015483.cif $ #-------------------------------------------------------------------...
1,008,547
3.996
0.003
3.996
0.003
10.478
0.007
90
null
90
null
90
null
167.3
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Neodymium manganese silicide (1/2/2)
- Mn2 Nd Si2 -
- Mn2 Nd Si2 -
- Mn4 Nd2 Si4 -
2
0.0625
Welter, R; Venturini, G; Fruchart, D; Malaman, B
Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies
Journal of Alloys Compd.
1,993
191
263
270
10.1016/0925-8388(93)90075-X
null
0.011
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Welter, R; Venturini, G; Fruchart, D; Malaman, B Magnetic structures of PrMn~2~Si~2~ and NdMn~2~Si~2~ from neutron diffraction studies Journal of Alloys Compd. 191 (1993) 263-270
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/1/00/85/1008547.cif $ #-------------------------------------------------------------------...
1,008,548
8.659
0.0008
8.659
0.0008
4.793
0.0005
90
null
90
null
90
null
359.4
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Yttrium iron molybdenum nitride (1/10.1/1.9/0.8)
- Fe10.12 Mo1.88 N0.8 Y -
- Fe10.12 Mo1.88 N0.8 Y -
- Fe20.24 Mo3.76 N1.6 Y2 -
2
0.0625
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D
Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H)
Journal of Alloys Compd.
1,993
191
233
238
10.1016/0925-8388(93)90070-4
null
0.017
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H) Journal of Alloys Compd. 191 (1993) 233-238
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/1/00/85/1008548.cif $ #-------------------------------------------------------------------...
1,008,549
8.6648
0.0006
8.6648
0.0006
4.8012
0.0005
90
null
90
null
90
null
360.5
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Yttrium iron molybdenum nitride (1/10.1/1.9/0.8)
- Fe10.12 Mo1.88 N0.8 Y -
- Fe10.12 Mo1.88 N0.8 Y -
- Fe20.24 Mo3.76 N1.6 Y2 -
2
0.0625
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D
Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H)
Journal of Alloys Compd.
1,993
191
233
238
10.1016/0925-8388(93)90070-4
null
0.022
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H) Journal of Alloys Compd. 191 (1993) 233-238
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/1/00/85/1008549.cif $ #-------------------------------------------------------------------...
1,008,550
8.6398
0.0009
8.6398
0.0009
4.8437
0.0006
90
null
90
null
90
null
361.6
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Neodymium iron molybdenum nitride (1/10.5/1.5/0.8)
- Fe10.52 Mo1.48 N0.8 Nd -
- Fe10.52 Mo1.48 N0.8 Nd -
- Fe21.04 Mo2.96 N1.6 Nd2 -
2
0.0625
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D
Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H)
Journal of Alloys Compd.
1,993
191
233
238
10.1016/0925-8388(93)90070-4
null
0.021
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H) Journal of Alloys Compd. 191 (1993) 233-238
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/1/00/85/1008550.cif $ #-------------------------------------------------------------------...
7,015,482
12.229
0.005
13.097
0.005
16.199
0.005
113.08
0.005
99.95
0.005
98.86
0.005
2,279.4
1.5
198
2
198
2
null
null
null
null
4
P -1
-P 1
2
- C59.5 H40 Co N6 -
- C59.5 H40 Co N6 -
- C119 H80 Co2 N12 -
2
1
Gresser, Roland; Hoyer, Alexander; Hummert, Markus; Hartmann, Horst; Leo, Karl; Riede, Moritz
Homoleptic Co(II), Ni(II), Cu(II), Zn(II) and Hg(II) complexes of bis-(phenyl)-diisoindol-aza-methene.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3476
3483
10.1039/c0dt01655a
0.71073
MoKα
0.0773
0.0482
null
null
0.0938
0.1119
null
null
null
null
null
1.202
null
null
has coordinates,has disorder
Gresser, Roland; Hoyer, Alexander; Hummert, Markus; Hartmann, Horst; Leo, Karl; Riede, Moritz Homoleptic Co(II), Ni(II), Cu(II), Zn(II) and Hg(II) complexes of bis-(phenyl)-diisoindol-aza-methene. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3476-3483
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/7/01/54/7015482.cif $ #-------------------------------------------------------------------...
1,008,551
8.646
0.001
8.646
0.001
4.8519
0.0006
90
null
90
null
90
null
362.7
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Neodymium iron molybdenum nitride (1/10.5/1.5/0.8)
- Fe10.48 Mo1.52 N0.8 Nd -
- Fe10.48 Mo1.52 N0.8 Nd -
- Fe20.96 Mo3.04 N1.6 Nd2 -
2
0.0625
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D
Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H)
Journal of Alloys Compd.
1,993
191
233
238
10.1016/0925-8388(93)90070-4
null
0.021
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Tomey, E; Isnard, O; Fagan, A; Desmoulins, C; Miraglia, S; Soubeyroux, J L; Fruchart, D Modulation of spin reorientation transitions in the series R(Fe,M)~12~X~y~ (R=Y,Nd,Ho;M=Mo,Ti;X=N,H) Journal of Alloys Compd. 191 (1993) 233-238
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/1/00/85/1008551.cif $ #-------------------------------------------------------------------...
1,008,552
7.275
0.002
9.452
0.001
13.569
0.002
90
null
90
null
90
null
933
null
null
null
null
null
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
Dicaesium oxotitanium diphosphate
- Cs2 O8 P2 Ti -
- Cs2 O8 P2 Ti -
- Cs8 O32 P8 Ti4 -
4
1
Protas, J; Menaert, B; Marnier, G; Boulanger, B
Structure cristalline de Cs~2~TiO(P~2~O~7~)
Acta Crystallographica C (39,1983-)
1,991
47
698
701
null
0.026
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Protas, J; Menaert, B; Marnier, G; Boulanger, B Structure cristalline de Cs~2~TiO(P~2~O~7~) Acta Crystallographica C (39,1983-) 47 (1991) 698-701
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/1/00/85/1008552.cif $ #-------------------------------------------------------------------...
1,008,553
19.58
0.01
7.388
0.005
7.451
0.005
90
null
102.32
0.1
90
null
1,053
null
null
null
null
null
null
null
null
null
4
C 1 2/c 1
-C 2yc
15
Iron(III) tris(phosphate) trihydroxide
- Fe4 H3 O15 P3 -
- Fe4 H6 O15 P3 -
- Fe16 H24 O60 P12 -
4
0.5
Malaman, M; Ijjaali, M; Venturini, G; Gleitzer, C; Soubeyroux, J L
Neutron diffraction study of Fe~4~(PO~4~)~3~(OH)~3~: occurrence of ferromagnetic Fe~2~O~9~ clusters
European Journal of Solid State Inorganic Chemistry
1,991
28
519
531
null
0.033
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Malaman, M; Ijjaali, M; Venturini, G; Gleitzer, C; Soubeyroux, J L Neutron diffraction study of Fe~4~(PO~4~)~3~(OH)~3~: occurrence of ferromagnetic Fe~2~O~9~ clusters European Journal of Solid State Inorganic Chemistry 28 (1991) 519-531
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/1/00/85/1008553.cif $ #-------------------------------------------------------------------...
1,008,554
3.897
0.0002
3.897
0.0002
11.573
0.004
90
null
90
null
90
null
175.8
null
null
null
null
null
null
null
null
null
6
P 4/m m m
-P 4 2
123
Calcium barium lanthanum copper aluminium oxide (0.5/1.5/1/2.4/0.6/6.7)
- Al0.58 Ba1.47 Ca0.53 Cu2.42 La O6.68 -
- Al0.58 Ba1.47 Ca0.53 Cu2.42 La O6.676 -
- Al0.58 Ba1.47 Ca0.53 Cu2.42 La O6.676 -
1
0.0625
Amador, U; Senaris, M A; Moran, E; Alario-Franco, M A; Vegas, A; Martinez-Ripoll, M; Ibanez, J
(CaBaLa)~3~(Cu~3-y~M~y~)O~7-x~ (M=Al, Pt) single crystals
European Journal of Solid State Inorganic Chemistry
1,991
28
611
624
null
0.055
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Amador, U; Senaris, M A; Moran, E; Alario-Franco, M A; Vegas, A; Martinez-Ripoll, M; Ibanez, J (CaBaLa)~3~(Cu~3-y~M~y~)O~7-x~ (M=Al, Pt) single crystals European Journal of Solid State Inorganic Chemistry 28 (1991) 611-624
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/1/00/85/1008554.cif $ #-------------------------------------------------------------------...
1,008,555
3.891
0.001
3.891
0.001
11.675
0.005
90
null
90
null
90
null
176.8
null
null
null
null
null
null
null
null
null
6
P 4/m m m
-P 4 2
123
Calcium barium lanthanum copper platinum oxide (0.5/1/1.5/2.8/0.2/6.5)
- Ba Ca0.49 Cu2.8 La1.51 O6.48 Pt0.2 -
- Ba Ca0.49 Cu2.8 La1.51 O6.476 Pt0.2 -
- Ba Ca0.49 Cu2.8 La1.51 O6.476 Pt0.2 -
1
0.0625
Amador, U; Senaris, M A; Moran, E; Alario-Franco, M A; Vegas, A; Martinez-Ripoll, M; Ibanez, J
(CaBaLa)~3~(Cu~3-y~M~y~)O~7-x~ (M=Al, Pt) single crystals
European Journal of Solid State Inorganic Chemistry
1,991
28
611
624
null
0.075
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Amador, U; Senaris, M A; Moran, E; Alario-Franco, M A; Vegas, A; Martinez-Ripoll, M; Ibanez, J (CaBaLa)~3~(Cu~3-y~M~y~)O~7-x~ (M=Al, Pt) single crystals European Journal of Solid State Inorganic Chemistry 28 (1991) 611-624
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/1/00/85/1008555.cif $ #-------------------------------------------------------------------...
1,008,556
13.986
0.006
3.78
0.001
4.065
0.001
90
null
93.99
0.02
90
null
214.4
null
null
null
null
null
null
null
null
null
3
C 1 2/m 1
-C 2y
12
Deuterium molybdenum oxide (1.6/1/3)
- D1.64 Mo O3 -
- D1.64 Mo O3 -
- D6.56 Mo4 O12 -
4
0.5
Anne, M; Fruchart, D; Derdour, S; Tinet, D
Structure of D~1.65~ Mo O~3~ by neutron diffraction
Journal de Physique (Paris)
1,988
49
505
509
10.1051/jphys:01988004903050500
null
0.148
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Anne, M; Fruchart, D; Derdour, S; Tinet, D Structure of D~1.65~ Mo O~3~ by neutron diffraction Journal de Physique (Paris) 49 (1988) 505-509
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/1/00/85/1008556.cif $ #-------------------------------------------------------------------...
1,008,557
8.727
0.001
8.727
0.001
12.687
0.001
90
null
90
null
120
null
836.8
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Cerium iron nitride (2/17/3)
- Ce2 Fe17 N3 -
- Ce2 Fe17 N3 -
- Ce6 Fe51 N9 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D
Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd
Journal of Alloys Compd.
1,992
190
129
135
10.1016/0925-8388(92)90189-G
null
0.0157
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd Journal of Alloys Compd. 190 (1992) 129-135
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/1/00/85/1008557.cif $ #-------------------------------------------------------------------...
7,015,481
12.93
0.004
14.224
0.004
22.326
0.006
84.783
0.004
88.519
0.004
64.047
0.004
3,676.3
1.8
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
- C53 H83 N5 O19 Pt15 -
- C53 H83 N5 O19 Pt15 -
- C106 H166 N10 O38 Pt30 -
2
1
Gao, F.; Li, C.; Heaton, B. T.; Zacchini, S.; Zarra, S.; Longoni, G.; Garland, M.
The inter-conversions of platinum carbonyl dianionic clusters, [Pt3(CO)6](n)2- (n = 2-5), in THF and acetonitrile. A combined in situ FTIR spectroscopic and BTEM study leading to the characterization of the new [H(4-x)Pt15(CO)19]x- (x = 2-4) clusters.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
5002
5008
10.1039/c0dt01654c
0.71073
MoKα
0.0856
0.0593
null
null
0.1459
0.1637
null
null
null
null
null
0.975
null
null
has coordinates,has disorder
Gao, F.; Li, C.; Heaton, B. T.; Zacchini, S.; Zarra, S.; Longoni, G.; Garland, M. The inter-conversions of platinum carbonyl dianionic clusters, [Pt3(CO)6](n)2- (n = 2-5), in THF and acetonitrile. A combined in situ FTIR spectroscopic and BTEM study leading to the characterization of the new [H(4-x)Pt15(CO)19]x- (x = 2...
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/7/01/54/7015481.cif $ #-------------------------------------------------------------------...
1,008,558
8.737
0.001
8.737
0.001
12.702
0.001
90
null
90
null
120
null
839.7
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Cerium iron nitride (2/17/3)
- Ce2 Fe17 N3 -
- Ce2 Fe17 N3 -
- Ce6 Fe51 N9 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D
Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd
Journal of Alloys Compd.
1,992
190
129
135
10.1016/0925-8388(92)90189-G
null
0.0304
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd Journal of Alloys Compd. 190 (1992) 129-135
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/1/00/85/1008558.cif $ #-------------------------------------------------------------------...
1,008,559
8.75
0.001
8.75
0.001
12.626
0.001
90
null
90
null
120
null
837.2
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Neodymium iron nitride (2/17/3)
- Fe17 N3 Nd2 -
- Fe17 N3 Nd2 -
- Fe51 N9 Nd6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D
Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd
Journal of Alloys Compd.
1,992
190
129
135
10.1016/0925-8388(92)90189-G
null
0.016
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd Journal of Alloys Compd. 190 (1992) 129-135
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/1/00/85/1008559.cif $ #-------------------------------------------------------------------...
1,008,560
8.786
0.001
8.786
0.001
12.626
0.001
90
null
90
null
120
null
844.1
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Neodymium iron nitride (2/17/3)
- Fe17 N3 Nd2 -
- Fe17 N3 Nd2 -
- Fe51 N9 Nd6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D
Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd
Journal of Alloys Compd.
1,992
190
129
135
10.1016/0925-8388(92)90189-G
null
0.0124
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D Nitrogen gas pressure synthesis and neutron diffraction study of R~2~Fe~17~N~3~ with R=Ce and Nd Journal of Alloys Compd. 190 (1992) 129-135
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/1/00/85/1008560.cif $ #-------------------------------------------------------------------...
1,008,561
8.4318
null
8.4318
null
8.4318
null
90
null
90
null
90
null
599.5
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Lithium iron oxide (0.9/2/3)
- Fe2 Li0.87 O3 -
- Fe2.0004 Li0.8696 O1.5 -
- Fe4.0008 Li1.7392 O3 -
2
0.010417
Bonnet, B.; Strobel, P.; Pernet, M.; Gondrand, M.; Gros, Y.; Mouget, C.; Chabre, Y.
Structural aspects of lithium insertion into γ-Fe~2~O~3~
Materials Science Forum
1,992
null
345
350
10.4028/www.scientific.net/MSF.91-93.345
null
0.0565
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bonnet, B.; Strobel, P.; Pernet, M.; Gondrand, M.; Gros, Y.; Mouget, C.; Chabre, Y. Structural aspects of lithium insertion into γ-Fe~2~O~3~ Materials Science Forum 91-93 (1992) 345-350
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/1/00/85/1008561.cif $ #-------------------------------------------------------------------...
1,008,562
3.8413
0.0004
3.8413
0.0004
3.8413
0.0004
90
null
90
null
90
null
56.7
null
null
null
null
null
null
null
null
null
3
P m -3 m
-P 4 2 3
221
Iron zirconium fluoride (0.8/0.2/3.2)
- F3.2 Fe0.8 Zr0.2 -
- F3.1992 Fe0.7998 Zr0.1998 -
- F3.1992 Fe0.7998 Zr0.1998 -
1
0.020833
Ruchaud, N; Grannec, J; Hagenmuller, P; Soubeyroux, J L
A neutron diffraction study of the anion-excess cubic ReO~3~-type derived phase Fe~0.80~Zr~0.20~F~3.20~
Journal of Alloys Compd.
1,992
183
263
270
10.1016/0925-8388(92)90750-4
null
0.017
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ruchaud, N; Grannec, J; Hagenmuller, P; Soubeyroux, J L A neutron diffraction study of the anion-excess cubic ReO~3~-type derived phase Fe~0.80~Zr~0.20~F~3.20~ Journal of Alloys Compd. 183 (1992) 263-270
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/1/00/85/1008562.cif $ #-------------------------------------------------------------------...
7,015,480
11.019
0.0009
14.89
0.0012
22.0694
0.0018
90
null
102.55
0.001
90
null
3,534.5
0.5
185
2
185
2
null
null
null
null
6
C 1 2/c 1
-C 2yc
15
- C38 H50 Cl N4 O V -
- C38 H50 Cl N4 O V -
- C152 H200 Cl4 N16 O4 V4 -
4
0.5
Mu, Jing-Shan; Wang, Yong-Xia; Li, Bai-Xiang; Li, Yue-Sheng
Synthesis of vanadium(III) complexes bearing iminopyrrolyl ligands and their role as thermal robust ethylene (co)polymerization catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3490
3497
10.1039/c0dt01650k
0.71073
MoKα
0.0594
0.0513
null
null
0.1405
0.1464
null
null
null
null
null
1.061
null
null
has coordinates
Mu, Jing-Shan; Wang, Yong-Xia; Li, Bai-Xiang; Li, Yue-Sheng Synthesis of vanadium(III) complexes bearing iminopyrrolyl ligands and their role as thermal robust ethylene (co)polymerization catalysts. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3490-3497
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/7/01/54/7015480.cif $ #-------------------------------------------------------------------...
1,008,563
5.4055
0.0009
5.4055
0.0009
8.7964
0.0007
90
null
90
null
120
null
222.6
null
null
null
null
null
null
null
null
null
3
P 63/m m c
-P 6c 2c
194
Zirconium manganese deuteride (1/2/3)
- D3.054 Mn2 Zr -
- D3.054 Mn2 Zr -
- D12.216 Mn8 Zr4 -
4
0.166667
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P
Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides
Journal of Alloys Compd.
1,992
186
241
248
10.1016/0925-8388(92)90010-7
null
0.057
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides Journal of Alloys Compd. 186 (1992) 241-248
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/1/00/85/1008563.cif $ #-------------------------------------------------------------------...
1,008,564
5.3889
0.001
5.3889
0.001
8.766
0.0011
90
null
90
null
120
null
220.5
null
null
null
null
null
null
null
null
null
3
P 63/m m c
-P 6c 2c
194
Zirconium manganese deuteride (0.9/2.2/2.3)
- D2.332 Mn2.15 Zr0.85 -
- D2.3325 Mn2.15 Zr0.85 -
- D9.33 Mn8.6 Zr3.4 -
4
0.166667
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P
Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides
Journal of Alloys Compd.
1,992
186
241
248
10.1016/0925-8388(92)90010-7
null
0.06
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides Journal of Alloys Compd. 186 (1992) 241-248
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/1/00/85/1008564.cif $ #-------------------------------------------------------------------...
1,008,565
5.3889
0.001
5.3889
0.001
8.766
0.0011
90
null
90
null
120
null
220.5
null
null
null
null
null
null
null
null
null
3
P 63/m m c
-P 6c 2c
194
Zirconium manganese deuteride (1/2/2.8)
- D2.83 Mn2 Zr -
- D2.8305 Mn2 Zr -
- D11.322 Mn8 Zr4 -
4
0.166667
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P
Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides
Journal of Alloys Compd.
1,992
186
241
248
10.1016/0925-8388(92)90010-7
null
0.06
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides Journal of Alloys Compd. 186 (1992) 241-248
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/1/00/85/1008565.cif $ #-------------------------------------------------------------------...
1,008,566
5.3493
0.0009
5.3493
0.0009
8.6995
0.0009
90
null
90
null
120
null
215.6
null
null
null
null
null
null
null
null
null
3
P 63/m m c
-P 6c 2c
194
Zirconium manganese deuteride (0.8/2.2/2.1)
- D2.113 Mn2.227 Zr0.772 -
- D2.1135 Mn2.227 Zr0.772 -
- D8.454 Mn8.908 Zr3.088 -
4
0.166667
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P
Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides
Journal of Alloys Compd.
1,992
186
241
248
10.1016/0925-8388(92)90010-7
null
0.055
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pontonnier, L; Miraglia, S; Fruchart, D; Soubeyroux, J L; Baudry, A; Boyer, P Structural study of hyperstoichiometric alloys ZrMn~2+x~ and their hydrides Journal of Alloys Compd. 186 (1992) 241-248
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/1/00/85/1008566.cif $ #-------------------------------------------------------------------...
1,008,567
5.5899
0.0002
5.5899
0.0002
7.7153
0.0003
90
null
90
null
90
null
241.1
null
null
null
null
null
null
null
null
null
5
P 4/m b m
-P 4 2ab
127
Barium strontium copper oxide carbonate (1/1/1/2.05/1)
- C Ba Cu O5.05 Sr -
- C Ba Cu O5.05 Sr -
- C2 Ba2 Cu2 O10.1 Sr2 -
2
0.125
Chaillout, C; Huang, Q; Cava, R J; Chenavas, J; Santoro, A; Bordet, P; Hodeau, J L; Krajewski, J J; Levy, J P; Marezio, M; Peck, W F jr
Synthesis and crystal structure of BaSrCuO~2+x~CO~3~
Physica C (Amsterdam) (152,1988-)
1,992
195
335
344
10.1016/0921-4534(92)90358-J
null
0.059
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Chaillout, C; Huang, Q; Cava, R J; Chenavas, J; Santoro, A; Bordet, P; Hodeau, J L; Krajewski, J J; Levy, J P; Marezio, M; Peck, W F jr Synthesis and crystal structure of BaSrCuO~2+x~CO~3~ Physica C (Amsterdam) (152,1988-) 195 (1992) 335-344
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/1/00/85/1008567.cif $ #-------------------------------------------------------------------...
7,015,479
9.3696
0.0007
15.8826
0.0012
16.5052
0.0013
95.561
0.001
106.305
0.001
90.222
0.001
2,345.1
0.3
185
2
185
2
null
null
null
null
6
P -1
-P 1
2
- C38 H54 Cl2 N3 O2 V -
- C38 H54 Cl2 N3 O2 V -
- C76 H108 Cl4 N6 O4 V2 -
2
1
Mu, Jing-Shan; Wang, Yong-Xia; Li, Bai-Xiang; Li, Yue-Sheng
Synthesis of vanadium(III) complexes bearing iminopyrrolyl ligands and their role as thermal robust ethylene (co)polymerization catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3490
3497
10.1039/c0dt01650k
0.71073
MoKα
0.0706
0.0492
null
null
0.1194
0.1289
null
null
null
null
null
0.982
null
null
has coordinates,has disorder
Mu, Jing-Shan; Wang, Yong-Xia; Li, Bai-Xiang; Li, Yue-Sheng Synthesis of vanadium(III) complexes bearing iminopyrrolyl ligands and their role as thermal robust ethylene (co)polymerization catalysts. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3490-3497
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/7/01/54/7015479.cif $ #-------------------------------------------------------------------...
1,008,568
5.336
0.004
5.336
0.004
8.7
0.001
90
null
90
null
120
null
214.5
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese iron deuteride (0.6/1.5/0.8/1.5)
- D1.539 Fe0.82 Mn1.538 Zr0.642 -
- D1.53885 Fe0.82 Mn1.538 Zr0.642 -
- D6.1554 Fe3.28 Mn6.152 Zr2.568 -
4
0.166667
Triantafillidis, G; Pontonnier, L; Fruchart, D; Wolfers, P; Soubeyroux, J L
Effect of hydrogen absorption on the structural properties of the hyperstoichiometric alloys Zr(Mn~0.72~Fe~0.28~)~2+x~
Journal of the Less-Common Metals
1,991
172
183
190
null
0.036
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Triantafillidis, G; Pontonnier, L; Fruchart, D; Wolfers, P; Soubeyroux, J L Effect of hydrogen absorption on the structural properties of the hyperstoichiometric alloys Zr(Mn~0.72~Fe~0.28~)~2+x~ Journal of the Less-Common Metals 172 (1991) 183-190
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/1/00/85/1008568.cif $ #-------------------------------------------------------------------...
1,008,569
5.336
0.005
5.336
0.005
8.697
0.005
90
null
90
null
120
null
214.5
null
null
null
null
null
null
null
null
null
4
P 63/m m c
-P 6c 2c
194
Zirconium manganese iron hydride (0.7/1.7/0.5/4.1)
- Fe0.512 H4.072 Mn1.738 Zr0.749 -
- Fe0.5125 H4.0725 Mn1.7385 Zr0.749 -
- Fe2.05 H16.29 Mn6.954 Zr2.996 -
4
0.166667
Triantafillidis, G; Pontonnier, L; Fruchart, D; Wolfers, P; Soubeyroux, J L
Effect of hydrogen absorption on the structural properties of the hyperstoichiometric alloys Zr(Mn~0.72~Fe~0.28~)~2+x~
Journal of the Less-Common Metals
1,991
172
183
190
null
0.037
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Triantafillidis, G; Pontonnier, L; Fruchart, D; Wolfers, P; Soubeyroux, J L Effect of hydrogen absorption on the structural properties of the hyperstoichiometric alloys Zr(Mn~0.72~Fe~0.28~)~2+x~ Journal of the Less-Common Metals 172 (1991) 183-190
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/1/00/85/1008569.cif $ #-------------------------------------------------------------------...
1,008,570
13.663
0.001
5.213
0.001
14.326
0.001
90
null
91.49
0.01
90
null
1,020
null
null
null
null
null
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Barium manganese copper aluminium fluoride (2/1/1/2/14)
- Al2 Ba2 Cu F14 Mn -
- Al2 Ba2 Cu F14 Mn -
- Al8 Ba8 Cu4 F56 Mn4 -
4
0.5
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
0.053
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/1/00/85/1008570.cif $ #-------------------------------------------------------------------...
1,008,571
13.658
0.004
5.205
0.002
14.38
0.004
90
null
91.08
0.02
90
null
1,022.1
null
null
null
null
null
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Barium manganese cobalt aluminium fluoride (2/1/1/2/14)
- Al2 Ba2 Co F14 Mn -
- Al2 Ba2 Co F14 Mn -
- Al8 Ba8 Co4 F56 Mn4 -
4
0.5
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
0.053
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/1/00/85/1008571.cif $ #-------------------------------------------------------------------...
7,015,478
7.7215
0.001
9.2893
0.0012
9.7711
0.0012
104.628
0.001
92.464
0.002
103.546
0.002
655.37
0.14
293
2
293
2
null
null
null
null
6
P -1
-P 1
2
- C11 H14 Cd1.5 N O7 P -
- C11 H14 Cd1.5 N O7 P -
- C22 H28 Cd3 N2 O14 P2 -
2
1
Tong, Fei; Sun, Zhen-Gang; Chen, Kai; Zhu, Yan-Yu; Wang, Wei-Nan; Jiao, Cheng-Qi; Wang, Cheng-Lin; Li, Chao
Hydrothermal synthesis, structures, and luminescent properties of zinc(II) and cadmium(II) phosphonates with a 3D framework structure using terephthalate as second linkers.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
5059
5065
10.1039/c0dt01649g
0.71073
MoKα
0.0332
0.031
null
null
0.0748
0.0762
null
null
null
null
null
1.055
null
null
has coordinates
Tong, Fei; Sun, Zhen-Gang; Chen, Kai; Zhu, Yan-Yu; Wang, Wei-Nan; Jiao, Cheng-Qi; Wang, Cheng-Lin; Li, Chao Hydrothermal synthesis, structures, and luminescent properties of zinc(II) and cadmium(II) phosphonates with a 3D framework structure using terephthalate as second linkers. Dalton transactions (Cambridge, England...
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/7/01/54/7015478.cif $ #-------------------------------------------------------------------...
1,008,572
5.35
0.001
13.148
0.006
5.398
0.003
90
null
90
null
90
null
379.7
null
null
null
null
null
null
null
null
null
3
C m c a
-C 2ac 2
64
Lanthanum copper oxide (2/1/4)
- Cu La2 O4 -
- Cu La2 O4 -
- Cu4 La8 O16 -
4
null
Chaillout, C; Bordet, P; Chenavas, J; Cheong, S W; Fisk, Z; Marezio, M; Morosin, B; Schirber, J E
Structural aspects of the phase separation in La~2~CuO~4.032~
Materials Research Society Symposia Proceedings
1,990
169
47
52
10.1557/PROC-169-47
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Chaillout, C; Bordet, P; Chenavas, J; Cheong, S W; Fisk, Z; Marezio, M; Morosin, B; Schirber, J E Structural aspects of the phase separation in La~2~CuO~4.032~ Materials Research Society Symposia Proceedings 169 (1990) 47-52
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/1/00/85/1008572.cif $ #-------------------------------------------------------------------...
1,008,573
5.35
0.001
13.148
0.006
5.398
0.003
90
null
90
null
90
null
379.7
null
null
null
null
null
null
null
null
null
3
F m m m
-F 2 2
69
Lanthanum copper oxide (2/1/4.02)
- Cu La2 O4.024 -
- Cu La2 O4.024 -
- Cu4 La8 O16.096 -
4
0.125
Chaillout, C; Bordet, P; Chenavas, J; Cheong, S W; Fisk, Z; Marezio, M; Morosin, B; Schirber, J E
Structural aspects of the phase separation in La~2~CuO~4.032~
Materials Research Society Symposia Proceedings
1,990
169
47
52
10.1557/PROC-169-47
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Chaillout, C; Bordet, P; Chenavas, J; Cheong, S W; Fisk, Z; Marezio, M; Morosin, B; Schirber, J E Structural aspects of the phase separation in La~2~CuO~4.032~ Materials Research Society Symposia Proceedings 169 (1990) 47-52
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/1/00/85/1008573.cif $ #-------------------------------------------------------------------...
1,008,574
13.784
0.001
6.631
0.001
10.537
0.001
90
null
103.66
0.01
90
null
935.9
null
null
null
null
null
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Thallium tetrafluoromanganate(III) hydrate
- F4 H2 Mn O Tl -
- F4 H2 Mn O Tl -
- F32 H16 Mn8 O8 Tl8 -
8
1
Nunez, P; Tressaud, A; Hahn, F; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L
A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF~4~.H~2~O
Physica Status Solidi, Sectio A: Applied Research
1,991
127
505
517
10.1002/pssa.2211270227
null
0.034
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Nunez, P; Tressaud, A; Hahn, F; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF~4~.H~2~O Physica Status Solidi, Sectio A: Applied Research 127 (1991) 505-517
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/1/00/85/1008574.cif $ #-------------------------------------------------------------------...
1,008,575
13.6775
0.0001
6.5865
0.0002
10.389
0.0003
90
null
103.176
0.001
90
null
911.3
null
null
null
null
null
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Thallium tetrafluoromanganate(III) hydrate
- F4 H2 Mn O Tl -
- F4 H4 Mn O Tl -
- F32 H32 Mn8 O8 Tl8 -
8
1
Nunez, P; Tressaud, A; Hahn, F; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L
A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF~4~.H~2~O
Physica Status Solidi, Sectio A: Applied Research
1,991
127
505
517
10.1002/pssa.2211270227
null
0.022
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Nunez, P; Tressaud, A; Hahn, F; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF~4~.H~2~O Physica Status Solidi, Sectio A: Applied Research 127 (1991) 505-517
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/1/00/85/1008575.cif $ #-------------------------------------------------------------------...
1,008,576
13.838
0.007
6.429
0.005
10.486
0.001
90
null
103.97
0.01
90
null
905.3
null
null
null
null
null
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Rubidium tetrafluoromanganate(III) hydrate
- F4 H2 Mn O Rb -
- F4 H4 Mn O Rb -
- F32 H32 Mn8 O8 Rb8 -
8
1
Nunez, P; Tressaud, A; Hahn, F; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L
A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF~4~.H~2~O
Physica Status Solidi, Sectio A: Applied Research
1,991
127
505
517
10.1002/pssa.2211270227
null
0.05
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Nunez, P; Tressaud, A; Hahn, F; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L A new 1D-antiferromagnet: crystal and magnetic structures of TlMnF~4~.H~2~O Physica Status Solidi, Sectio A: Applied Research 127 (1991) 505-517
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/1/00/85/1008576.cif $ #-------------------------------------------------------------------...
7,015,477
26.592
0.01
9.229
0.003
10.178
0.004
90
null
103.289
0.005
90
null
2,431
1.5
293
2
293
2
null
null
null
null
6
C 1 2/c 1
-C 2yc
15
- C11 H11 N O5 P Zn -
- C11 H11 N O5 P Zn -
- C88 H88 N8 O40 P8 Zn8 -
8
1
Tong, Fei; Sun, Zhen-Gang; Chen, Kai; Zhu, Yan-Yu; Wang, Wei-Nan; Jiao, Cheng-Qi; Wang, Cheng-Lin; Li, Chao
Hydrothermal synthesis, structures, and luminescent properties of zinc(II) and cadmium(II) phosphonates with a 3D framework structure using terephthalate as second linkers.
Dalton transactions (Cambridge, England : 2003)
2,011
40
18
5059
5065
10.1039/c0dt01649g
0.71073
MoKα
0.1072
0.0581
null
null
0.1188
0.1394
null
null
null
null
null
1.014
null
null
has coordinates
Tong, Fei; Sun, Zhen-Gang; Chen, Kai; Zhu, Yan-Yu; Wang, Wei-Nan; Jiao, Cheng-Qi; Wang, Cheng-Lin; Li, Chao Hydrothermal synthesis, structures, and luminescent properties of zinc(II) and cadmium(II) phosphonates with a 3D framework structure using terephthalate as second linkers. Dalton transactions (Cambridge, England...
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/7/01/54/7015477.cif $ #-------------------------------------------------------------------...
1,008,577
8.9018
0.0002
8.9018
0.0002
22.2021
0.0006
90
null
90
null
120
null
1,523.6
null
null
null
null
null
null
null
null
null
4
R -3 c :H
-R 3 2"c
167
Copper(I) dizirconium phosphate
- Cu O12 P3 Zr2 -
- Cu1.0002 O12 P3 Zr2 -
- Cu6.0012 O72 P18 Zr12 -
6
0.166667
Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G
Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction
Acta Crystallographica C (39,1983-)
1,992
48
1741
1744
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction Acta Crystallographica C (39,1983-) 48 (1992) 1741-1744
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/1/00/85/1008577.cif $ #-------------------------------------------------------------------...
1,008,578
8.892
0.001
8.892
0.001
22.19
0.001
90
null
90
null
120
null
1,519.5
null
null
null
null
null
null
null
null
null
4
R -3 c :H
-R 3 2"c
167
Copper(I) dizirconium phosphate
- Cu O12 P3 Zr2 -
- Cu1.0002 O12 P3 Zr2 -
- Cu6.0012 O72 P18 Zr12 -
6
0.166667
Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G
Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction
Acta Crystallographica C (39,1983-)
1,992
48
1741
1744
null
0.056
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction Acta Crystallographica C (39,1983-) 48 (1992) 1741-1744
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/1/00/85/1008578.cif $ #-------------------------------------------------------------------...
1,008,579
8.597
0.001
8.597
0.001
12.489
0.002
90
null
90
null
120
null
799.4
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/0.3)
- Fe17 Th2 -
- C0.276 Fe17 Th2 -
- C0.828 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.022
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008579.cif $ #-------------------------------------------------------------------...
1,008,580
8.643
0.001
8.643
0.001
12.516
0.002
90
null
90
null
120
null
809.7
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/0.6)
- Fe17 Th2 -
- C0.624 Fe17 Th2 -
- C1.872 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.019
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008580.cif $ #-------------------------------------------------------------------...
1,008,581
8.65
0.001
8.65
0.001
12.494
0.002
90
null
90
null
120
null
809.6
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/0.8)
- Fe17 Th2 -
- C0.84 Fe17 Th2 -
- C2.52 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.03
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008581.cif $ #-------------------------------------------------------------------...
1,008,582
8.699
0.001
8.699
0.001
12.533
0.002
90
null
90
null
120
null
821.3
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/1.1)
- Fe17 Th2 -
- C1.08 Fe17 Th2 -
- C3.24 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.04
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008582.cif $ #-------------------------------------------------------------------...
7,015,476
12.2286
0.0009
17.4493
0.0013
25.3574
0.0019
90
null
90
null
90
null
5,410.8
0.7
298
2
298
2
null
null
null
null
5
P b c a
-P 2ac 2ab
61
- C29 H22 F6 Fe2 N4 -
- C29 H22 F6 Fe2 N4 -
- C232 H176 F48 Fe16 N32 -
8
1
Zhang, Qiong; Song, Wen-Li; Showkot Hossain, A. M.; Liu, Zhao-Di; Hu, Gui-Ju; Tian, Yu-Peng; Wu, Jie-Ying; Jin, Bao-Kang; Zhou, Hong-Ping; Yang, Jia-Xiang; Zhang, Sheng-Yi
Synthesis, crystal structure, electrochemistry and in situ FTIR spectroelectrochemistry of a bisferrocene pyrazole derivative.
Dalton transactions (Cambridge, England : 2003)
2,011
40
14
3510
3516
10.1039/c0dt01648a
0.71073
MoKα
0.0572
0.0424
null
null
0.1417
0.1563
null
null
null
null
null
1.17
null
null
has coordinates,has disorder
Zhang, Qiong; Song, Wen-Li; Showkot Hossain, A. M.; Liu, Zhao-Di; Hu, Gui-Ju; Tian, Yu-Peng; Wu, Jie-Ying; Jin, Bao-Kang; Zhou, Hong-Ping; Yang, Jia-Xiang; Zhang, Sheng-Yi Synthesis, crystal structure, electrochemistry and in situ FTIR spectroelectrochemistry of a bisferrocene pyrazole derivative. Dalton transactions (...
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/7/01/54/7015476.cif $ #-------------------------------------------------------------------...
1,008,583
8.69
0.002
8.69
0.002
12.51
0.003
90
null
90
null
120
null
818.1
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/1.2)
- Fe17 Th2 -
- C1.236 Fe17 Th2 -
- C3.708 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.03
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008583.cif $ #-------------------------------------------------------------------...
1,008,584
8.606
0.001
8.606
0.001
12.492
0.001
90
null
90
null
120
null
801.2
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/0.3)
- Fe17 Th2 -
- C0.276 Fe17 Th2 -
- C0.828 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.019
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008584.cif $ #-------------------------------------------------------------------...
1,008,585
8.643
0.001
8.643
0.001
12.504
0.001
90
null
90
null
120
null
808.9
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/0.6)
- Fe17 Th2 -
- C0.624 Fe17 Th2 -
- C1.872 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.021
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008585.cif $ #-------------------------------------------------------------------...
1,008,586
8.666
0.001
8.666
0.001
12.508
0.001
90
null
90
null
120
null
813.5
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/0.9)
- Fe17 Th2 -
- C0.912 Fe17 Th2 -
- C2.736 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.012
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008586.cif $ #-------------------------------------------------------------------...
1,008,587
8.697
0.001
8.697
0.001
12.518
0.001
90
null
90
null
120
null
820
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/1.1)
- Fe17 Th2 -
- C1.08 Fe17 Th2 -
- C3.24 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.019
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008587.cif $ #-------------------------------------------------------------------...
1,008,588
8.741
0.001
8.741
0.001
12.558
0.001
90
null
90
null
120
null
830.9
null
null
null
null
null
null
null
null
null
2
R -3 m :H
-R 3 2"
166
Thorium iron carbide (2/17/1.2)
- Fe17 Th2 -
- C1.164 Fe17 Th2 -
- C3.492 Fe51 Th6 -
3
0.083333
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J
Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25)
Journal of Alloys Compd.
1,992
186
135
145
10.1016/0925-8388(92)90627-L
null
0.035
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Structural and magnetic behaviour of the series Th~2~Fe~17~C~x~ (x=0 to 1.25) Journal of Alloys Compd. 186 (1992) 135-145
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/1/00/85/1008588.cif $ #-------------------------------------------------------------------...
7,015,475
9.4885
0.0008
11.4201
0.0011
19.3015
0.0017
92.688
0.011
90.529
0.01
112.629
0.01
1,927.5
0.3
170
2
170
2
null
null
null
null
5
P -1
-P 1
2
- C43 H44 Mo N4 P4 -
- C43 H44 Mo N4 P4 -
- C86 H88 Mo2 N8 P8 -
2
1
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix
One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3229
3236
10.1039/c0dt01646b
0.71073
MoKα
0.0952
0.0725
null
null
0.1884
0.2007
null
null
null
null
null
1.141
null
null
has coordinates,has disorder
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W. Dalton transac...
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/7/01/54/7015475.cif $ #-------------------------------------------------------------------...
1,008,589
8.7449
0.0003
8.7449
0.0003
21.819
0.001
90
null
90
null
120
null
1,445
null
null
null
null
null
null
null
null
null
5
R -3 c :H
-R 3 2"c
167
Dicopper(I) chromium zirconium tris(phosphate)
- Cr Cu2 O12 P3 Zr -
- Cr Cu1.9998 O12 P3 Zr -
- Cr6 Cu11.9988 O72 P18 Zr6 -
6
0.166667
Boireau, A; Soubeyroux, J L; Gravereau, P; Olazcuaga, R; Le Flem, G
Structure of Cu^I^~2~CrZr(PO~4~)~3~ by powder neutron diffraction
Journal of Alloys Compd.
1,992
188
113
116
10.1016/0925-8388(92)90655-S
null
0.039
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Boireau, A; Soubeyroux, J L; Gravereau, P; Olazcuaga, R; Le Flem, G Structure of Cu^I^~2~CrZr(PO~4~)~3~ by powder neutron diffraction Journal of Alloys Compd. 188 (1992) 113-116
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/1/00/85/1008589.cif $ #-------------------------------------------------------------------...
1,008,590
6.1557
0.0001
6.1557
0.0001
6.1557
0.0001
90
null
90
null
90
null
233.3
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Barium bismuth fluoride (0.9/0.1/2.1)
- Ba0.9 Bi0.1 F2.1 -
- Ba0.9 Bi0.1 F2.1 -
- Ba3.6 Bi0.4 F8.4 -
4
0.020833
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K
Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution
Solid State Communications
1,992
82
2
63
70
10.1016/0038-1098(92)90673-W
null
0.041
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution Solid State Communications 82(2) (1992) 63-70
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/1/00/85/1008590.cif $ #-------------------------------------------------------------------...
1,008,591
6.1118
0.0001
6.1118
0.0001
6.1118
0.0001
90
null
90
null
90
null
228.3
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Barium bismuth fluoride (0.8/0.2/2.2)
- Ba0.8 Bi0.2 F2.2 -
- Ba0.8 Bi0.2 F2.2 -
- Ba3.2 Bi0.8 F8.8 -
4
0.020833
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K
Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution
Solid State Communications
1,992
82
2
63
70
10.1016/0038-1098(92)90673-W
null
0.046
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution Solid State Communications 82(2) (1992) 63-70
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/1/00/85/1008591.cif $ #-------------------------------------------------------------------...
1,008,592
6.0773
0.0002
6.0773
0.0002
6.0773
0.0002
90
null
90
null
90
null
224.5
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Barium bismuth fluoride (0.7/0.3/2.3)
- Ba0.7 Bi0.3 F2.3 -
- Ba0.7 Bi0.3 F2.2996 -
- Ba2.8 Bi1.2 F9.1984 -
4
0.020833
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K
Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution
Solid State Communications
1,992
82
2
63
70
10.1016/0038-1098(92)90673-W
null
0.031
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution Solid State Communications 82(2) (1992) 63-70
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/1/00/85/1008592.cif $ #-------------------------------------------------------------------...
1,008,593
6.0377
0.0002
6.0377
0.0002
6.0377
0.0002
90
null
90
null
90
null
220.1
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Barium bismuth fluoride (0.6/0.4/2.4)
- Ba0.6 Bi0.4 F2.4 -
- Ba0.6 Bi0.4 F2.4004 -
- Ba2.4 Bi1.6 F9.6016 -
4
0.020833
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K
Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution
Solid State Communications
1,992
82
2
63
70
10.1016/0038-1098(92)90673-W
null
0.033
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Reau, J M; Wahbi, M; Senegas; Soo, S K Neutron diffraction investigation of the Ba~1-x~Bi~x~F~2-x~ solid solution Solid State Communications 82(2) (1992) 63-70
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/1/00/85/1008593.cif $ #-------------------------------------------------------------------...
1,008,594
3.8714
0.0005
3.8714
0.0005
23.269
0.007
90
null
90
null
90
null
348.7
null
null
null
null
null
null
null
null
null
4
I 4/m m m
-I 4 2
139
Thallium barium copper oxide (1.9/2/1.1/6)
- Ba2 Cu1.06 O6 Tl1.94 -
- Ba2 Cu1.0592 O6 Tl1.9408 -
- Ba4 Cu2.1184 O12 Tl3.8816 -
2
0.0625
Opagiste, C; Couach, M; Khoder, A F; Abraham, R; Jondo, T K; Jorda, J L; Cohen-Adad, M T; Junod, A; Triscone, G; Muller, J
A new elaboration process of the superconducting Tl~2~Ba~2~CuO~6~ phase with T~c~=90K
Journal of Alloys Compd.
1,993
195
47
52
10.1016/0925-8388(93)90684-F
null
0.019
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Opagiste, C; Couach, M; Khoder, A F; Abraham, R; Jondo, T K; Jorda, J L; Cohen-Adad, M T; Junod, A; Triscone, G; Muller, J A new elaboration process of the superconducting Tl~2~Ba~2~CuO~6~ phase with T~c~=90K Journal of Alloys Compd. 195 (1993) 47-52
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/1/00/85/1008594.cif $ #-------------------------------------------------------------------...
1,008,595
8.398
0.001
8.398
0.001
8.398
0.001
90
null
90
null
90
null
592.3
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Lithium titanium oxide (0.9/2/4)
- Li0.93 O4 Ti2 -
- Li0.93 O4 Ti2 -
- Li7.44 O32 Ti16 -
8
0.041667
Moshopoulou, E; Bordet, P; Capponi, J J; Chaillout, C; Souletie, B; Sulpice, A
Evolution of structure and superconductivity with lithium content in Li~1-x~Ti~2~O~4~
Journal of Alloys Compd.
1,993
195
81
84
10.1016/0925-8388(93)90692-G
null
0.007
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Moshopoulou, E; Bordet, P; Capponi, J J; Chaillout, C; Souletie, B; Sulpice, A Evolution of structure and superconductivity with lithium content in Li~1-x~Ti~2~O~4~ Journal of Alloys Compd. 195 (1993) 81-84
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/1/00/85/1008595.cif $ #-------------------------------------------------------------------...
7,015,474
12.965
0.0017
14.378
0.0018
12.9795
0.0016
90
null
90.445
0.008
90
null
2,419.4
0.5
173
2
173
2
null
null
null
null
4
P 1 21/n 1
-P 2yn
14
Hzapp
- C25 H30 N4 O6 -
- C25 H30 N4 O6 -
- C100 H120 N16 O24 -
4
1
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix
One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3229
3236
10.1039/c0dt01646b
0.71073
MoKα
0.0809
0.043
null
null
0.0952
0.1124
null
null
null
null
null
1.014
null
null
has coordinates
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W. Dalton transac...
202,017
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-14 22:27:35 +0300 (Sat, 14 Oct 2017) $ #$Revision: 202017 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015474.cif $ #-------------------------------------------------------------------...
1,008,596
8.387
0.001
8.387
0.001
8.387
0.001
90
null
90
null
90
null
590
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Lithium titanium oxide (0.9/2/4)
- Li0.89 O4 Ti2 -
- Li0.89 O4 Ti2 -
- Li7.12 O32 Ti16 -
8
0.041667
Moshopoulou, E; Bordet, P; Capponi, J J; Chaillout, C; Souletie, B; Sulpice, A
Evolution of structure and superconductivity with lithium content in Li~1-x~Ti~2~O~4~
Journal of Alloys Compd.
1,993
195
81
84
10.1016/0925-8388(93)90692-G
null
0.01
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Moshopoulou, E; Bordet, P; Capponi, J J; Chaillout, C; Souletie, B; Sulpice, A Evolution of structure and superconductivity with lithium content in Li~1-x~Ti~2~O~4~ Journal of Alloys Compd. 195 (1993) 81-84
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/1/00/85/1008596.cif $ #-------------------------------------------------------------------...
1,008,597
8.386
0.001
8.386
0.001
8.386
0.001
90
null
90
null
90
null
589.7
null
null
null
null
null
null
null
null
null
3
F d -3 m :2
-F 4vw 2vw 3
227
Lithium titanium oxide (0.9/2/4)
- Li0.86 O4 Ti2 -
- Li0.86 O4 Ti2 -
- Li6.88 O32 Ti16 -
8
0.041667
Moshopoulou, E; Bordet, P; Capponi, J J; Chaillout, C; Souletie, B; Sulpice, A
Evolution of structure and superconductivity with lithium content in Li~1-x~Ti~2~O~4~
Journal of Alloys Compd.
1,993
195
81
84
10.1016/0925-8388(93)90692-G
null
0.012
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Moshopoulou, E; Bordet, P; Capponi, J J; Chaillout, C; Souletie, B; Sulpice, A Evolution of structure and superconductivity with lithium content in Li~1-x~Ti~2~O~4~ Journal of Alloys Compd. 195 (1993) 81-84
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/1/00/85/1008597.cif $ #-------------------------------------------------------------------...
1,008,598
6.2165
0.0006
6.2165
0.0006
12.326
0.001
90
null
90
null
90
null
476.3
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Nickel titanium hydride (1/1/0.95)
- H0.95 Ni Ti -
- H0.95 Ni Ti -
- H15.2 Ni16 Ti16 -
16
0.5
Soubeyroux, J L; Fruchart, D; Lorthioir, G; Ochin, P; Colin, D
Structural study of the hydrides NiTiH~x~ (x=1.0 and 1.4)
Journal of Alloys Compd.
1,993
196
127
132
10.1016/0925-8388(93)90582-8
null
0.011
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Fruchart, D; Lorthioir, G; Ochin, P; Colin, D Structural study of the hydrides NiTiH~x~ (x=1.0 and 1.4) Journal of Alloys Compd. 196 (1993) 127-132
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/1/00/85/1008598.cif $ #-------------------------------------------------------------------...
1,008,599
6.2364
0.0005
6.2364
0.0005
12.424
0.002
90
null
90
null
90
null
483.2
null
null
null
null
null
null
null
null
null
3
I 4/m m m
-I 4 2
139
Nickel titanium deuteride (1/1/1.4)
- D1.4 Ni Ti -
- D1.4 Ni Ti -
- D22.4 Ni16 Ti16 -
16
0.5
Soubeyroux, J L; Fruchart, D; Lorthioir, G; Ochin, P; Colin, D
Structural study of the hydrides NiTiH~x~ (x=1.0 and 1.4)
Journal of Alloys Compd.
1,993
196
127
132
10.1016/0925-8388(93)90582-8
null
0.028
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Soubeyroux, J L; Fruchart, D; Lorthioir, G; Ochin, P; Colin, D Structural study of the hydrides NiTiH~x~ (x=1.0 and 1.4) Journal of Alloys Compd. 196 (1993) 127-132
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/1/00/85/1008599.cif $ #-------------------------------------------------------------------...
1,008,600
8.802
null
8.802
null
12.737
null
90
null
90
null
120
null
854.6
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Thorium iron nitride (2/17/3)
- Fe17 N2.964 Th2 -
- Fe17 N2.964 Th2 -
- Fe51 N8.892 Th6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J
Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~
Journal of Physics: Condensed Matter
1,993
5
5481
5490
10.1088/0953-8984/5/31/012
null
0.008
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~ Journal of Physics: Condensed Matter 5 (1993) 5481-5490
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/1/00/86/1008600.cif $ #-------------------------------------------------------------------...
1,008,601
8.7653
null
8.7653
null
12.691
null
90
null
90
null
120
null
844.4
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Thorium iron nitride (2/17/3)
- Fe17 N2.964 Th2 -
- Fe17 N2.964 Th2 -
- Fe51 N8.892 Th6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J
Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~
Journal of Physics: Condensed Matter
1,993
5
5481
5490
10.1088/0953-8984/5/31/012
null
0.012
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~ Journal of Physics: Condensed Matter 5 (1993) 5481-5490
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/1/00/86/1008601.cif $ #-------------------------------------------------------------------...
7,015,473
7.5438
0.0008
9.0878
0.0009
11.3719
0.0012
85.485
0.006
78.375
0.006
69.76
0.005
716.44
0.13
173
2
173
2
null
null
null
null
4
P -1
-P 1
2
Hdapp
- C15 H20 N2 O3 -
- C15 H20 N2 O3 -
- C30 H40 N4 O6 -
2
1
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix
One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3229
3236
10.1039/c0dt01646b
0.71069
MoKα
0.0676
0.0459
null
null
0.1173
0.1281
null
null
null
null
null
1.067
null
null
has coordinates
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W. Dalton transac...
202,017
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-14 22:27:35 +0300 (Sat, 14 Oct 2017) $ #$Revision: 202017 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/54/7015473.cif $ #-------------------------------------------------------------------...
1,008,602
8.7116
null
8.7116
null
12.624
null
90
null
90
null
120
null
829.7
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Thorium iron deuteride (2/17/5)
- D4.956 Fe17 Th2 -
- D4.956 Fe17 Th2 -
- D14.868 Fe51 Th6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J
Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~
Journal of Physics: Condensed Matter
1,993
5
5481
5490
10.1088/0953-8984/5/31/012
null
0.007
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~ Journal of Physics: Condensed Matter 5 (1993) 5481-5490
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/1/00/86/1008602.cif $ #-------------------------------------------------------------------...
1,008,603
8.682
null
8.682
null
12.56
null
90
null
90
null
120
null
819.9
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Thorium iron deuteride (2/17/4.7)
- D4.668 Fe17 Th2 -
- D4.668 Fe17 Th2 -
- D14.004 Fe51 Th6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J
Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~
Journal of Physics: Condensed Matter
1,993
5
5481
5490
10.1088/0953-8984/5/31/012
null
0.01
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~ Journal of Physics: Condensed Matter 5 (1993) 5481-5490
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/1/00/86/1008603.cif $ #-------------------------------------------------------------------...
1,008,604
8.7457
null
8.7457
null
12.65
null
90
null
90
null
120
null
837.9
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Thorium iron carbide hydride (2/17/0.6/4.3)
- Fe17 H4.272 Th2 -
- C0.624 H4.272 Fe17 Th2 -
- C1.872 H12.816 Fe51 Th6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J
Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~
Journal of Physics: Condensed Matter
1,993
5
5481
5490
10.1088/0953-8984/5/31/012
null
0.005
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~ Journal of Physics: Condensed Matter 5 (1993) 5481-5490
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/1/00/86/1008604.cif $ #-------------------------------------------------------------------...
1,008,605
8.751
null
8.751
null
12.643
null
90
null
90
null
120
null
838.5
null
null
null
null
null
null
null
null
null
3
R -3 m :H
-R 3 2"
166
Thorium iron carbide hydride (2/17/0.6/4.3)
- Fe17 H4.284 Th2 -
- C0.588 H4.284 Fe17 Th2 -
- C1.764 H12.852 Fe51 Th6 -
3
0.083333
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J
Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~
Journal of Physics: Condensed Matter
1,993
5
5481
5490
10.1088/0953-8984/5/31/012
null
0.004
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Isnard, O; Miraglia, S; Soubeyroux, J L; Fruchart, D; Deportes, J; Buschow, K H J Structural study and magnetic characterization of Th~2~Fe~17~D~5~, Th~2~Fe~17~C~x~H~5-x~ and Th~2~Fe~17~N~3~ Journal of Physics: Condensed Matter 5 (1993) 5481-5490
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/1/00/86/1008605.cif $ #-------------------------------------------------------------------...
1,008,606
6.479
0.003
6.569
0.003
6.559
0.003
96.89
0.04
93.44
0.04
95.74
0.04
275
null
null
null
null
null
null
null
null
null
3
P -1
-P 1
2
COPPER MOLYBDENUM SULFIDE (1.8/6/8) - AT 250K
- Cu1.8 Mo6 S8 -
- Cu1.8 Mo6 S8 -
- Cu1.8 Mo6 S8 -
1
0.5
Baillif, R; Yvon, K; Fluekiger, R; Muller, J
The tricilic structure of Cu~1.8~ Mo~6~ S~8~ in the superconducting state
Journal of Low Temperature Physics
1,979
37
2319
2379
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Baillif, R; Yvon, K; Fluekiger, R; Muller, J The tricilic structure of Cu~1.8~ Mo~6~ S~8~ in the superconducting state Journal of Low Temperature Physics 37 (1979) 2319-2379
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/1/00/86/1008606.cif $ #-------------------------------------------------------------------...
7,015,472
17.027
0.003
9.5242
0.0019
18.442
0.004
90
null
104.05
0.03
90
null
2,901.2
1.1
173
1
173
1
null
null
null
null
7
P 1 21/n 1
-P 2yn
14
- C30 H20 Br2 Cu N4 O4 S2 -
- C30 H20 Br2 Cu N4 O4 S2 -
- C120 H80 Br8 Cu4 N16 O16 S8 -
4
1
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix
One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3229
3236
10.1039/c0dt01646b
0.71073
MoKα
0.1035
0.0497
null
null
0.1119
0.1182
null
null
null
null
null
0.927
null
null
has coordinates
Römer, René; Gradert, Christian; Bannwarth, Alexander; Peters, Gerhard; Näther, Christian; Tuczek, Felix One-step synthesis of Mo(0) and W(0) bis(dinitrogen) complexes with the linear tetraphosphine ligand prP4: stereoselective formation of cis-[M(N2)2(rac-prP4)] and trans-[M(N2)2(meso-prP4)]; M = Mo, W. Dalton transac...
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/7/01/54/7015472.cif $ #-------------------------------------------------------------------...
1,008,607
12.7853
null
12.7853
null
12.7853
null
90
null
90
null
90
null
2,089.9
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Manganese yttrium deuteride (23/6/8.3)
- D8.3 Mn23 Y6 -
- D8.3 Mn23 Y6 -
- D33.2 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
0.056
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/1/00/86/1008607.cif $ #-------------------------------------------------------------------...