file
int64
a
float64
siga
float64
b
float64
sigb
float64
c
float64
sigc
float64
alpha
float64
sigalpha
float64
beta
float64
sigbeta
float64
gamma
float64
siggamma
float64
vol
float64
sigvol
float64
celltemp
float64
sigcelltemp
float64
diffrtemp
float64
sigdiffrtemp
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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
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journal
string
year
int64
volume
int64
issue
string
firstpage
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string
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float64
radType
string
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string
Rall
float64
Robs
float64
Rref
float64
wRall
float64
wRobs
float64
wRref
float64
RFsqd
float64
RI
float64
gofall
float64
gofobs
float64
gofgt
float64
gofref
float64
duplicateof
int64
optimal
int64
status
string
flags
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svnrevision
int64
date
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cif_text
string
1,100,816
12.611
0.003
12.665
0.002
14.887
0.002
72.302
0.012
70.461
0.013
68.172
0.015
2,035.8
0.6
293
2
293
2
null
null
null
null
7
P -1
-P 1
2
- C46 H43 F3 N Ni O P -
- C46 H43 F3 N Ni O P -
- C92 H86 F6 N2 Ni2 O2 P2 -
2
1
Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai
Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands
Organometallics
2,005
24
10
2502
2510
10.1021/om049080w
0.71073
MoKα
0.0781
0.0405
null
null
0.0643
0.0696
null
null
null
null
null
0.872
null
null
has coordinates
Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands Organometallics 24(10) (2005) 2502-2510
187,722
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-11-01 10:45:47 +0200 (Tue, 01 Nov 2016) $ #$Revision: 187722 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100816.cif $ #-------------------------------------------------------------------...
1,100,817
10.782
0.003
38.013
0.011
10.424
0.003
90
null
114.18
0.02
90
null
3,897.5
1.9
293
2
293
2
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
- C46 H46 N Ni O P -
- C46 H46 N Ni O P -
- C184 H184 N4 Ni4 O4 P4 -
4
1
Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai
Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands
Organometallics
2,005
24
10
2502
2510
10.1021/om049080w
0.71073
MoKα
0.0998
0.0438
null
null
0.0723
0.079
null
null
null
null
null
0.915
null
null
has coordinates
Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands Organometallics 24(10) (2005) 2502-2510
187,722
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-11-01 10:45:47 +0200 (Tue, 01 Nov 2016) $ #$Revision: 187722 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100817.cif $ #-------------------------------------------------------------------...
1,100,818
9.299
0.003
21.609
0.006
18.37
0.013
90
null
96.7
0.03
90
null
3,666
3
293
2
293
2
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
- C41 H41 F3 N Ni O P -
- C41 H41 F3 N Ni O P -
- C164 H164 F12 N4 Ni4 O4 P4 -
4
1
Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai
Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands
Organometallics
2,005
24
10
2502
2510
10.1021/om049080w
0.71073
MoKα
0.1164
0.0677
null
null
0.1763
0.1924
null
null
null
null
null
1.02
null
null
has coordinates
Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands Organometallics 24(10) (2005) 2502-2510
187,722
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-11-01 10:45:47 +0200 (Tue, 01 Nov 2016) $ #$Revision: 187722 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100818.cif $ #-------------------------------------------------------------------...
1,100,819
16.342
0.003
30.139
0.006
29.457
0.006
90
null
102.68
0.03
90
null
14,155
5
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C111 H208 N8 O24 Si16 -
- C111 H208 N8 O24 Si16 -
- C444 H832 N32 O96 Si64 -
4
1
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J.
Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate
Organometallics
2,005
24
9
2124
2128
10.1021/om049254+
0.71073
MoKα
0.1082
0.0634
null
null
0.1525
0.1709
null
null
null
null
null
1
4,060,451
null
has coordinates
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J. Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate Organometallics 24(9) (2005) 2124-2128
209,049
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-16 04:05:44 +0300 (Mon, 16 Jul 2018) $ #$Revision: 209049 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100819.cif $ #-------------------------------------------------------------------...
1,100,820
9.728
0.003
9.696
0.003
13.71
0.002
77.332
0.01
74.774
0.013
64.301
0.016
1,116.1
0.5
294
2
294
2
null
null
null
null
5
P -1
-P 1
2
- C17 H35 N3 O3 Si2 -
- C17 H35 N3 O3 Si2 -
- C34 H70 N6 O6 Si4 -
2
1
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J.
Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate
Organometallics
2,005
24
9
2124
2128
10.1021/om049254+
0.71073
MoKα
0.0747
0.0647
null
null
0.1801
0.1924
null
null
null
null
null
1.039
4,060,452
null
has coordinates
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J. Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate Organometallics 24(9) (2005) 2124-2128
209,049
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-16 04:05:44 +0300 (Mon, 16 Jul 2018) $ #$Revision: 209049 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100820.cif $ #-------------------------------------------------------------------...
1,100,821
13.849
0.0016
15.341
0.0015
13.394
0.002
90
null
114.812
0.012
90
null
2,583
0.5
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C23 H33 N3 O3 Si2 -
- C23 H33 N3 O3 Si2 -
- C92 H132 N12 O12 Si8 -
4
1
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J.
Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate
Organometallics
2,005
24
9
2124
2128
10.1021/om049254+
0.71073
MoKα
0.1919
0.0612
null
null
0.1499
0.1879
null
null
null
null
null
0.998
4,060,453
null
has coordinates
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J. Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate Organometallics 24(9) (2005) 2124-2128
209,049
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-16 04:05:44 +0300 (Mon, 16 Jul 2018) $ #$Revision: 209049 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100821.cif $ #-------------------------------------------------------------------...
1,100,822
14.498
0.0017
14.498
0.0017
52.767
0.003
90
null
90
null
90
null
11,091.2
1.9
293
2
293
2
null
null
null
null
6
I 41
I 4bw
80
- C40 H72 Al2 N6 O7 Si4 -
- C40 H72 Al2 N6 O7 Si4 -
- C320 H576 Al16 N48 O56 Si32 -
8
1
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J.
Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate
Organometallics
2,005
24
9
2124
2128
10.1021/om049254+
0.71073
MoKα
0.3304
0.1155
null
null
0.2932
0.3987
null
null
null
null
null
1.059
4,060,454
null
has coordinates
Prabusankar, Ganesan; Murugavel, Ramaswamy; Butcher, Ray J. Synthesis, Spectral Studies, and Structural Characterization of a New Organosilanetriol, Its Amine Complexes, and a Surface Lewis Basic Cubic Aluminosilicate Organometallics 24(9) (2005) 2124-2128
209,049
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-16 04:05:44 +0300 (Mon, 16 Jul 2018) $ #$Revision: 209049 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100822.cif $ #-------------------------------------------------------------------...
1,100,823
10.0582
0.0005
10.9779
0.0006
28.1698
0.0015
90
null
90
null
90
null
3,110.5
0.3
163
2
163
2
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
- C31 H51 Si2 Y -
- C31 H51 Si2 Y -
- C124 H204 Si8 Y4 -
4
1
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J.
Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands
Organometallics
2,005
24
10
2269
2278
10.1021/om049286x
0.71073
MoKα
0.0681
0.0426
null
null
0.0861
0.0968
null
null
null
null
null
1.024
null
null
has coordinates
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
282,633
2023-04-14
12:39:59
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100823.cif $ #-------------------------------------------------------------------...
1,100,824
11.0875
0.001
19.7843
0.0018
15.6311
0.0014
90
null
93.695
0.002
90
null
3,421.7
0.5
171
2
171
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C64 H116 Al2 Si4 Y2 -
- C64 H116 Al2 Si4 Y2 -
- C128 H232 Al4 Si8 Y4 -
2
0.5
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J.
Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands
Organometallics
2,005
24
10
2269
2278
10.1021/om049286x
0.71073
MoKα
0.1233
0.0531
null
null
0.1111
0.1381
null
null
null
null
null
1.021
null
null
has coordinates
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
282,633
2023-04-14
12:40:02
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100824.cif $ #-------------------------------------------------------------------...
1,100,825
29.2318
0.0015
29.2318
0.0015
10.1105
0.0007
90
null
90
null
90
null
8,639.4
0.9
163
2
163
2
null
null
null
null
4
I 41 c d
I 4bw -2c
110
- C23 H35 Si Y -
- C23 H30 Si Y -
- C368 H480 Si16 Y16 -
16
1
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J.
Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands
Organometallics
2,005
24
10
2269
2278
10.1021/om049286x
0.71073
MoKα
0.0485
0.0361
null
null
0.0896
0.0965
null
null
null
null
null
1.074
null
null
has coordinates
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
282,633
2023-04-14
12:40:04
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100825.cif $ #-------------------------------------------------------------------...
1,100,826
22.5779
0.0005
22.5779
0.0005
8.4111
0.0003
90
null
90
null
90
null
4,287.7
0.2
163
2
163
2
null
null
null
null
3
I -4
I -4
82
- C23 H35 Lu -
- C23 H35 Lu -
- C184 H280 Lu8 -
8
1
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J.
Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands
Organometallics
2,005
24
10
2269
2278
10.1021/om049286x
0.71073
MoKα
0.0237
0.0214
null
null
0.0492
0.0504
null
null
null
null
null
1.073
null
null
has coordinates
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
282,633
2023-04-14
12:40:07
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100826.cif $ #-------------------------------------------------------------------...
1,100,827
8.9218
0.0011
17.632
0.002
13.6181
0.0017
90
null
90.066
0.002
90
null
2,142.3
0.5
163
2
163
2
null
null
null
null
3
P 1 21/n 1
-P 2yn
14
- C23 H35 Y -
- C23 H35 Y -
- C92 H140 Y4 -
4
1
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J.
Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands
Organometallics
2,005
24
10
2269
2278
10.1021/om049286x
0.71073
MoKα
0.0499
0.0304
null
null
0.0671
0.0732
null
null
null
null
null
1.056
null
null
has coordinates
Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
282,633
2023-04-14
12:40:08
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100827.cif $ #-------------------------------------------------------------------...
1,100,828
12.115
0.0004
9.2921
0.0003
9.9839
0.0002
90
null
91.525
0.002
90
null
1,123.52
0.05
113.2
null
null
null
null
null
null
null
3
C 1 c 1
C -2yc
9
- C14 H14 Zr -
- C14 H14 Zr -
- C56 H56 Zr4 -
4
1
Suzuki, Noriyuki; Watanabe, Takaaki; Iwasaki, Masakazu; Chihara, Teiji
Reaction of 1-Zirconacyclopent-3-yne with "Zirconocene": Synthesis and Structure of Bimetallic 1,2,3-Butatriene Complexes
Organometallics
2,005
24
9
2065
2069
10.1021/om049288h
0.7107
MoKα
null
0.0242
null
null
null
0.0677
null
null
null
null
null
0.929
4,060,460
null
has coordinates
Suzuki, Noriyuki; Watanabe, Takaaki; Iwasaki, Masakazu; Chihara, Teiji Reaction of 1-Zirconacyclopent-3-yne with "Zirconocene": Synthesis and Structure of Bimetallic 1,2,3-Butatriene Complexes Organometallics 24(9) (2005) 2065-2069
210,313
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-09-01 20:09:12 +0300 (Sat, 01 Sep 2018) $ #$Revision: 210313 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100828.cif $ #-------------------------------------------------------------------...
1,100,829
8.7249
0.0006
7.9789
0.0006
13.8141
0.0008
90
null
91.116
0.003
90
null
961.5
0.1
93.2
null
null
null
null
null
null
null
3
P 1 21/n 1
-P 2yn
14
- C24 H24 Zr2 -
- C24 H24 Zr2 -
- C48 H48 Zr4 -
2
0.5
Suzuki, Noriyuki; Watanabe, Takaaki; Iwasaki, Masakazu; Chihara, Teiji
Reaction of 1-Zirconacyclopent-3-yne with "Zirconocene": Synthesis and Structure of Bimetallic 1,2,3-Butatriene Complexes
Organometallics
2,005
24
9
2065
2069
10.1021/om049288h
0.7107
MoKα
null
0.0558
null
null
null
0.1353
null
null
null
null
null
1.575
4,060,461
null
has coordinates
Suzuki, Noriyuki; Watanabe, Takaaki; Iwasaki, Masakazu; Chihara, Teiji Reaction of 1-Zirconacyclopent-3-yne with "Zirconocene": Synthesis and Structure of Bimetallic 1,2,3-Butatriene Complexes Organometallics 24(9) (2005) 2065-2069
210,313
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-09-01 20:09:12 +0300 (Sat, 01 Sep 2018) $ #$Revision: 210313 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100829.cif $ #-------------------------------------------------------------------...
1,100,830
13.1163
0.0002
16.2269
0.0003
14.1022
0.0003
90
null
117.693
0.001
90
null
2,657.65
0.09
143
2
143
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C28 H26 Au Cl2 P -
- C28 H26 Au Cl2 P -
- C112 H104 Au4 Cl8 P4 -
4
1
Schuster, Oliver; Schmidbaur, Hubert
Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup>
Organometallics
2,005
24
10
2289
2296
10.1021/om050038q
0.71073
MoKα
0.0407
0.0371
null
null
0.0937
0.0961
null
null
null
null
null
1.124
null
null
has coordinates
Schuster, Oliver; Schmidbaur, Hubert Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup> Organometallics 24(10) (2005) 2289-2296
282,633
2023-04-14
12:40:11
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100830.cif $ #-------------------------------------------------------------------...
1,100,831
17.2772
0.0001
18.3213
0.0002
18.6586
0.0002
90
null
90
null
90
null
5,906.21
0.1
143
2
143
2
null
null
null
null
4
P b c a
-P 2ac 2ab
61
- C32 H46 Au N -
- C32 H46 Au N -
- C256 H368 Au8 N8 -
8
1
Schuster, Oliver; Schmidbaur, Hubert
Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup>
Organometallics
2,005
24
10
2289
2296
10.1021/om050038q
0.71073
MoKα
0.0426
0.04
null
null
0.1229
0.126
null
null
null
null
null
1.081
null
null
has coordinates
Schuster, Oliver; Schmidbaur, Hubert Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup> Organometallics 24(10) (2005) 2289-2296
282,633
2023-04-14
12:40:14
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100831.cif $ #-------------------------------------------------------------------...
1,100,832
8.9747
0.0002
12.4383
0.0003
17.9334
0.0005
78.1633
0.0012
84.1125
0.0013
78.1765
0.0019
1,913.93
0.08
143
2
143
2
null
null
null
null
5
P -1
-P 1
2
- C82 H106 Au2 Cl4 N2 -
- C82 H106 Au2 Cl4 N2 -
- C82 H106 Au2 Cl4 N2 -
1
0.5
Schuster, Oliver; Schmidbaur, Hubert
Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup>
Organometallics
2,005
24
10
2289
2296
10.1021/om050038q
0.71073
MoKα
0.0668
0.04
null
null
0.0763
0.0848
null
null
null
null
null
1.111
null
null
has coordinates
Schuster, Oliver; Schmidbaur, Hubert Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup> Organometallics 24(10) (2005) 2289-2296
282,633
2023-04-14
12:40:19
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100832.cif $ #-------------------------------------------------------------------...
1,100,833
8.9539
0.0005
12.9892
0.0008
15.4944
0.0011
83.782
0.005
79.915
0.005
78.659
0.002
1,734.47
0.19
143
2
143
2
null
null
null
null
5
P -1
-P 1
2
- C36 H28 Au Cl2 P -
- C36 H28 Au Cl2 P -
- C72 H56 Au2 Cl4 P2 -
2
1
Schuster, Oliver; Schmidbaur, Hubert
Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup>
Organometallics
2,005
24
10
2289
2296
10.1021/om050038q
0.71073
MoKα
0.0719
0.0597
null
null
0.1361
0.1434
null
null
null
null
null
1.182
null
null
has coordinates,has disorder
Schuster, Oliver; Schmidbaur, Hubert Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup> Organometallics 24(10) (2005) 2289-2296
282,633
2023-04-14
12:40:32
#------------------------------------------------------------------------------ #$Date: 2023-04-14 15:39:52 +0300 (Fri, 14 Apr 2023) $ #$Revision: 282633 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100833.cif $ #-------------------------------------------------------------------...
1,100,834
9.2632
0.0001
11.1278
0.0002
12.1561
0.0002
82.9382
0.0006
73.8315
0.0006
78.437
0.0009
1,176.05
0.03
143
2
143
2
null
null
null
null
4
P -1
-P 1
2
- C27 H24 Au P -
- C27 H24 Au P -
- C54 H48 Au2 P2 -
2
1
Schuster, Oliver; Schmidbaur, Hubert
Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup>
Organometallics
2,005
24
10
2289
2296
10.1021/om050038q
0.71073
MoKα
0.0232
0.0231
null
null
0.0615
0.0617
null
null
null
null
null
1.122
null
null
has coordinates
Schuster, Oliver; Schmidbaur, Hubert Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup> Organometallics 24(10) (2005) 2289-2296
282,777
2023-04-20
11:56:39
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100834.cif $ #-------------------------------------------------------------------...
1,100,835
8.8194
0.0001
8.8964
0.0001
14.4346
0.0002
76.275
0.001
86.03
0.001
84.964
0.001
1,094.59
0.02
200
2
200
2
null
null
null
null
6
P -1
-P 1
2
in_paper_11
- C19 H25 Co O S4 Si -
- C19 H25 Co O S4 Si -
- C38 H50 Co2 O2 S8 Si2 -
2
1
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank
CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations
Organometallics
2,005
24
9
2016
2113
10.1021/om050048r
0.71073
MoKα
0.0314
0.0263
null
null
0.0649
0.0673
null
null
null
null
null
1.058
4,060,509
null
has coordinates,has disorder
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations Organometallics 24(9) (2005) 2016-2113
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/1/10/08/1100835.cif $ #-------------------------------------------------------------------...
1,100,836
9.1494
0.0003
12.4455
0.0005
22.3392
0.0008
79.022
0.001
83.8
0.001
79.226
0.001
2,446.25
0.15
200
2
200
2
null
null
null
null
5
P -1
-P 1
2
in_paper_14
- C14 H17 Co O S4 -
- C14 H17 Co O S4 -
- C84 H102 Co6 O6 S24 -
6
3
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank
CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations
Organometallics
2,005
24
9
2016
2113
10.1021/om050048r
0.71073
MoKα
0.1305
0.0492
null
null
0.0668
0.0858
null
null
null
null
null
0.951
4,060,510
null
has coordinates
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations Organometallics 24(9) (2005) 2016-2113
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/1/10/08/1100836.cif $ #-------------------------------------------------------------------...
1,100,837
16.4714
0.0006
8.3209
0.0003
15.0158
0.0005
90
null
114.331
0.001
90
null
1,875.23
0.11
200
2
200
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
in_paper_15
- C16 H19 Co O3 S4 -
- C16 H19 Co O3 S4 -
- C64 H76 Co4 O12 S16 -
4
1
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank
CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations
Organometallics
2,005
24
9
2016
2113
10.1021/om050048r
0.71073
MoKα
0.0566
0.0319
null
null
0.0613
0.0715
null
null
null
null
null
1.038
4,060,511
null
has coordinates
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations Organometallics 24(9) (2005) 2016-2113
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/1/10/08/1100837.cif $ #-------------------------------------------------------------------...
1,100,838
7.9711
0.0001
14.6145
0.0002
17.7756
0.0001
90
null
95.805
0.001
90
null
2,060.13
0.04
200
2
200
2
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
in_paper_16
- C17 H25 Co O S4 Si -
- C17 H25 Co O S4 Si -
- C68 H100 Co4 O4 S16 Si4 -
4
1
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank
CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations
Organometallics
2,005
24
9
2016
2113
10.1021/om050048r
0.71073
MoKα
0.0411
0.0268
null
null
0.0573
0.0621
null
null
null
null
null
1.041
4,060,512
null
has coordinates
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations Organometallics 24(9) (2005) 2016-2113
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/1/10/08/1100838.cif $ #-------------------------------------------------------------------...
1,100,839
10.3437
0.0006
10.4068
0.0006
14.8969
0.0009
93.53
0.001
93.912
0.001
102.042
0.001
1,559.9
0.16
296
2
296
2
null
null
null
null
5
P -1
-P 1
2
in_paper_30
- C35 H27 Co O2 S4 -
- C35 H27 Co O2 S4 -
- C70 H54 Co2 O4 S8 -
2
1
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank
CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations
Organometallics
2,005
24
9
2016
2113
10.1021/om050048r
0.71073
MoKα
0.0499
0.0381
null
null
0.0972
0.1046
null
null
null
null
null
1.024
4,060,513
null
has coordinates
Schaefer, Carsten; Werz, Daniel B.; Staeb, Tobias H.; Gleiter, Rolf; Rominger, Frank CpCo-Stabilized Cyclopentadienones from Cyclobutadiene Complexes: Experimental and Theoretical Investigations Organometallics 24(9) (2005) 2016-2113
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/1/10/08/1100839.cif $ #-------------------------------------------------------------------...
1,100,840
7.3561
0.0001
14.3852
0.0003
11.9104
0.0002
90
null
90.843
0.0012
90
null
1,260.21
0.04
150
1
150
1
null
null
null
null
6
P 1 21 1
P 2yb
4
- C20 H44 Cl2 O P2 Ru -
- C20 H44 Cl2 O P2 Ru -
- C40 H88 Cl4 O2 P4 Ru2 -
2
1
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G.
Substituents Effects in POP Pincer Complexes of Ruthenium
Organometallics
2,005
24
10
2492
2501
10.1021/om050053v
0.71073
MoKα
0.0327
0.0286
null
null
0.0727
0.0752
null
null
null
null
null
1.017
null
null
has coordinates
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501
282,777
2023-04-20
11:56:39
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100840.cif $ #-------------------------------------------------------------------...
1,100,841
10.9035
0.0008
14.2678
0.0011
15.581
0.0013
68.844
0.004
89.075
0.005
83.462
0.005
2,245
0.3
150
1
150
1
null
null
null
null
7
P -1
-P 1
2
- C32 H72 Cl3 F6 O2 P5 Ru2 -
- C32 H72 Cl3 F6 O2 P5 Ru2 -
- C64 H144 Cl6 F12 O4 P10 Ru4 -
2
1
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G.
Substituents Effects in POP Pincer Complexes of Ruthenium
Organometallics
2,005
24
10
2492
2501
10.1021/om050053v
0.71073
MoKα
0.186
0.1039
null
null
0.2273
0.2738
null
null
null
null
null
1.037
null
null
has coordinates
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100841.cif $ #-------------------------------------------------------------------...
1,100,842
11.829
0.0003
13.4628
0.0004
15.2504
0.0003
79.474
0.0015
87.028
0.0014
73.807
0.0013
2,293.05
0.1
150
1
150
1
null
null
null
null
8
P -1
-P 1
2
- C45 H66 B Cl3 N2 O P2 Ru -
- C45 H66 B Cl3 N2 O P2 Ru -
- C90 H132 B2 Cl6 N4 O2 P4 Ru2 -
2
1
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G.
Substituents Effects in POP Pincer Complexes of Ruthenium
Organometallics
2,005
24
10
2492
2501
10.1021/om050053v
0.71073
MoKα
0.1021
0.0559
null
null
0.1234
0.1488
null
null
null
null
null
1.046
null
null
has coordinates
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100842.cif $ #-------------------------------------------------------------------...
1,100,843
10.7468
0.0004
16.5738
0.0004
12.9615
0.0005
90
null
109.736
0.0014
90
null
2,173.03
0.13
150
1
150
1
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
- C16 H38 Cl2 O P2 Ru -
- C16 H38 Cl2 O P2 Ru -
- C64 H152 Cl8 O4 P8 Ru4 -
4
1
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G.
Substituents Effects in POP Pincer Complexes of Ruthenium
Organometallics
2,005
24
10
2492
2501
10.1021/om050053v
0.71073
MoKα
0.0741
0.0403
null
null
0.0812
0.0944
null
null
null
null
null
1.078
null
null
has coordinates
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100843.cif $ #-------------------------------------------------------------------...
1,100,844
10.7245
0.0002
13.8487
0.0004
15.4083
0.0004
90
null
90
null
90
null
2,288.45
0.1
150
1
150
1
null
null
null
null
7
P 21 21 21
P 2ac 2ab
19
- C16 H36 Cl2 N2 O P2 Ru -
- C16 H36 Cl2 N2 O P2 Ru -
- C64 H144 Cl8 N8 O4 P8 Ru4 -
4
1
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G.
Substituents Effects in POP Pincer Complexes of Ruthenium
Organometallics
2,005
24
10
2492
2501
10.1021/om050053v
0.71073
MoKα
0.0493
0.036
null
null
0.0751
0.0815
null
null
null
null
null
1.085
null
null
has coordinates,has disorder
Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100844.cif $ #-------------------------------------------------------------------...
1,100,845
11.7581
0.0005
12.0235
0.0006
17.3035
0.0008
105.799
0.001
95.97
0.001
98.834
0.001
2,298.4
0.18
153
2
153
2
null
null
null
null
6
P -1
-P 1
2
[HFe(CH3CN)(PNP)(dmpm)][BPh4]
- C44 H68 B Fe N3 P4 -
- C44 H68 B Fe N3 P4 -
- C88 H136 B2 Fe2 N6 P8 -
2
1
Henry, Renee M.; Shoemaker, Richard K.; Newell, Rachel H.; Jacobsen, George M.; DuBois, Daniel L.; Rakowski DuBois, M.
Stereochemical Control of Iron(II) Complexes Containing a Diphosphine Ligand with a Pendant Nitrogen Base
Organometallics
null
24
10
2481
2491
10.1021/om050071c
0.71073
MoKα
0.0658
0.054
null
null
0.1403
0.1515
null
null
null
null
null
1.016
null
null
has coordinates
Henry, Renee M.; Shoemaker, Richard K.; Newell, Rachel H.; Jacobsen, George M.; DuBois, Daniel L.; Rakowski DuBois, M. Stereochemical Control of Iron(II) Complexes Containing a Diphosphine Ligand with a Pendant Nitrogen Base Organometallics 24(10) () 2481-2491
176,428
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176428 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100845.cif $ #-------------------------------------------------------------------...
1,100,846
21.873
0.01
13.629
0.006
24.754
0.011
90
null
109.824
0.01
90
null
6,942
6
154
2
154
2
null
null
null
null
7
P 1 21/n 1
-P 2yn
14
[Fe(PNP)2(CH3CN)(CO)](BPh4)2
- C73 H97 B2 Fe N3 O P4 -
- C73 H97 B2 Fe N3 O P4 -
- C292 H388 B8 Fe4 N12 O4 P16 -
4
1
Henry, Renee M.; Shoemaker, Richard K.; Newell, Rachel H.; Jacobsen, George M.; DuBois, Daniel L.; Rakowski DuBois, M.
Stereochemical Control of Iron(II) Complexes Containing a Diphosphine Ligand with a Pendant Nitrogen Base
Organometallics
null
24
10
2481
2491
10.1021/om050071c
0.71073
MoKα
0.2638
0.1074
null
null
0.223
0.3062
null
null
null
null
null
0.896
null
null
has coordinates
Henry, Renee M.; Shoemaker, Richard K.; Newell, Rachel H.; Jacobsen, George M.; DuBois, Daniel L.; Rakowski DuBois, M. Stereochemical Control of Iron(II) Complexes Containing a Diphosphine Ligand with a Pendant Nitrogen Base Organometallics 24(10) () 2481-2491
176,428
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176428 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100846.cif $ #-------------------------------------------------------------------...
1,100,847
33.5236
0.001
33.5236
0.001
8.7943
0.0004
90
null
90
null
90
null
9,883.3
0.6
100
2
100
2
null
null
null
null
5
I 41/a :2
-I 4ad
88
- C20 H38 B4 Cl2 Ru2 -
- C20 H38 B4 Cl2 Ru2 -
- C320 H608 B64 Cl32 Ru32 -
16
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.026
0.0241
null
null
0.0576
0.0586
null
null
null
null
null
1.132
null
null
has coordinates
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
211,332
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-10-05 15:19:55 +0300 (Fri, 05 Oct 2018) $ #$Revision: 211332 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100847.cif $ #-------------------------------------------------------------------...
1,100,848
9.0023
0.0003
9.5781
0.0004
16.027
0.0006
76.678
0.001
79.159
0.001
67.732
0.001
1,236.64
0.08
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
- C20 H36 B4 Cl2 Ru2 -
- C20 H36 B4 Cl2 Ru2 -
- C40 H72 B8 Cl4 Ru4 -
2
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.0251
0.0225
null
null
0.0556
0.057
null
null
null
null
null
1.042
null
null
has coordinates,has disorder
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100848.cif $ #-------------------------------------------------------------------...
1,100,849
10.5503
0.0004
13.9118
0.0005
17.6855
0.0007
90
null
105.063
0.001
90
null
2,506.58
0.16
100
2
100
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C20 H35 B4 Cl3 Ru2 -
- C20 H35 B4 Cl3 Ru2 -
- C80 H140 B16 Cl12 Ru8 -
4
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.0256
0.0228
null
null
0.0575
0.0589
null
null
null
null
null
1.025
null
null
has coordinates
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100849.cif $ #-------------------------------------------------------------------...
1,100,850
22.027
0.003
12.4145
0.0014
23.813
0.003
90
null
90
null
90
null
6,511.5
1.3
100
2
100
2
null
null
null
null
6
P b c a
-P 2ac 2ab
61
- C24.5 H43.84 B5 Cl3 Ru2 S -
- C24.5 H38 B5 Cl3 Ru2 S -
- C196 H304 B40 Cl24 Ru16 S8 -
8
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.0372
0.0348
null
null
0.1026
0.1041
null
null
null
null
null
1.163
null
null
has coordinates
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100850.cif $ #-------------------------------------------------------------------...
1,100,851
8.4861
0.0004
20.9284
0.001
15.954
0.0007
90
null
91.414
0.001
90
null
2,832.6
0.2
100
2
100
2
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
- C22 H38 B5 Cl3 Ru2 S -
- C22 H38 B5 Cl3 Ru2 S -
- C88 H152 B20 Cl12 Ru8 S4 -
4
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.0217
0.0203
null
null
0.0478
0.0484
null
null
null
null
null
1.081
null
null
has coordinates
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100851.cif $ #-------------------------------------------------------------------...
1,100,852
9.066
0.0005
32.7224
0.0017
9.1682
0.0005
90
null
111.444
0.001
90
null
2,531.6
0.2
100
2
100
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C20 H33 B6 Cl3 Ru2 -
- C20 H33 B6 Cl3 Ru2 -
- C80 H132 B24 Cl12 Ru8 -
4
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.051
0.0436
null
null
0.1052
0.1086
null
null
null
null
null
1.122
null
null
has coordinates
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100852.cif $ #-------------------------------------------------------------------...
1,100,853
14.5799
0.0009
11.3893
0.0007
17.7889
0.0011
90
null
94.371
0.001
90
null
2,945.3
0.3
100
2
100
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C21 H42 B6 Cl4 Ru2 -
- C21 H42 B6 Cl4 Ru2 -
- C84 H168 B24 Cl16 Ru8 -
4
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.0437
0.0323
null
null
0.0736
0.0786
null
null
null
null
null
1.027
null
null
has coordinates
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100853.cif $ #-------------------------------------------------------------------...
1,100,854
9.705
0.004
13.701
0.004
19.123
0.006
90
null
90
null
90
null
2,542.8
1.5
100
2
100
2
null
null
null
null
5
P 21 21 21
P 2ac 2ab
19
- C20 H41 B8 Cl Ru2 -
- C20 H39 B8 Cl Ru2 -
- C80 H156 B32 Cl4 Ru8 -
4
1
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C.
Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~
Organometallics
2,005
24
10
2473
2480
10.1021/om050083y
0.71073
MoKα
0.0476
0.0451
null
null
0.1095
0.1108
null
null
null
null
null
1.219
null
null
has coordinates,has disorder
Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and clos...
200,397
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-09 22:39:32 +0300 (Sat, 09 Sep 2017) $ #$Revision: 200397 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100854.cif $ #-------------------------------------------------------------------...
1,100,855
18.032
0.004
10.346
0.002
21.479
0.004
90
null
105.5
0.03
90
null
3,861.2
1.3
150
2
150
2
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
- C39 H40 Cl2 Fe4 N2 O8 -
- C39 H40 Cl2 Fe4 N2 O8 -
- C156 H160 Cl8 Fe16 N8 O32 -
4
1
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio
Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands
Organometallics
2,005
24
10
2297
2306
10.1021/om050095j
0.71073
MoKα
0.0584
0.0502
null
null
0.1353
0.1416
null
null
null
null
null
1.062
null
null
has coordinates
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics 24(10) (2005) 2297-2306
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100855.cif $ #-------------------------------------------------------------------...
1,100,856
9.3991
0.0019
19.964
0.004
10.132
0.002
90
null
109.83
0.03
90
null
1,788.5
0.6
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C20 H21 Fe N O2 -
- C20 H21 Fe N O2 -
- C80 H84 Fe4 N4 O8 -
4
1
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio
Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands
Organometallics
2,005
24
10
2297
2306
10.1021/om050095j
0.71073
MoKα
0.0892
0.0494
null
null
0.1252
0.1452
null
null
null
null
null
0.963
null
null
has coordinates
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics 24(10) (2005) 2297-2306
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100856.cif $ #-------------------------------------------------------------------...
1,100,857
12.735
0.003
27.48
0.006
10.206
0.002
90
null
112.8
0.03
90
null
3,292.8
1.1
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C36 H38 Fe4 N2 O4 -
- C36 H38 Fe4 N2 O4 -
- C144 H152 Fe16 N8 O16 -
4
1
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio
Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands
Organometallics
2,005
24
10
2297
2306
10.1021/om050095j
0.71073
MoKα
0.0956
0.0564
null
null
0.1226
0.1398
null
null
null
null
null
1.054
null
null
has coordinates,has disorder
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics 24(10) (2005) 2297-2306
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100857.cif $ #-------------------------------------------------------------------...
1,100,858
9.92
0.002
34.927
0.007
14.849
0.003
90
null
90
null
90
null
5,144.6
1.8
293
2
293
2
null
null
null
null
6
A b a 2
A 2 -2ab
41
- C27 H31 Fe2 N O2 Si -
- C27 H31 Fe2 N O2 Si -
- C216 H248 Fe16 N8 O16 Si8 -
8
null
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio
Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands
Organometallics
2,005
24
10
2297
2306
10.1021/om050095j
0.71073
MoKα
0.0692
0.0478
null
null
0.1113
0.1212
null
null
null
null
null
1.05
null
null
has coordinates,has disorder
Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics 24(10) (2005) 2297-2306
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100858.cif $ #-------------------------------------------------------------------...
1,100,859
14.7275
0.0005
28.8178
0.0009
9.7016
0.0003
90
null
90
null
90
null
4,117.5
0.2
150
2
150
2
null
null
null
null
5
F d d 2
F 2 -2d
43
- C21 H24 Au Cl N2 -
- C21 H24 Au Cl N2 -
- C168 H192 Au8 Cl8 N16 -
8
0.5
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0184
0.0161
null
null
0.0387
0.0396
null
null
null
null
null
1.094
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:40
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100859.cif $ #-------------------------------------------------------------------...
1,100,860
8.4242
0.0003
21.933
0.0009
11.2534
0.0005
90
null
91.06
0.001
90
null
2,078.91
0.15
150
2
150
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C21 H26 Au Cl N2 -
- C21 H26 Au Cl N2 -
- C84 H104 Au4 Cl4 N8 -
4
1
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0179
0.0173
null
null
0.0438
0.0441
null
null
null
null
null
1.187
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100860.cif $ #-------------------------------------------------------------------...
1,100,861
10.9098
0.0005
12.5994
0.0006
19.3635
0.0009
90
null
90
null
90
null
2,661.6
0.2
150
2
150
2
null
null
null
null
5
P c c n
-P 2ab 2ac
56
- C27 H38 Au Cl N2 -
- C27 H38 Au Cl N2 -
- C108 H152 Au4 Cl4 N8 -
4
0.5
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0263
0.0187
null
null
0.0426
0.0467
null
null
null
null
null
1.06
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100861.cif $ #-------------------------------------------------------------------...
1,100,862
8.084
0.0003
8.084
0.0003
20.631
0.0015
90
null
90
null
90
null
1,348.26
0.12
150
2
150
2
null
null
null
null
5
P 43 21 2
P 4nw 2abw
96
- C11 H20 Au Cl N2 -
- C11 H20 Au Cl N2 -
- C44 H80 Au4 Cl4 N8 -
4
0.5
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0206
0.0201
null
null
0.0494
0.0497
null
null
null
null
null
1.155
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100862.cif $ #-------------------------------------------------------------------...
1,100,863
10.405
0.002
8.4073
0.0018
11.068
0.002
90
null
90
null
90
null
968.3
0.4
396
2
396
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C7 H12 Au Cl N2 -
- C7 H12 Au Cl N2 -
- C28 H48 Au4 Cl4 N8 -
4
1
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0698
0.0477
null
null
0.1035
0.1102
null
null
null
null
null
1.08
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100863.cif $ #-------------------------------------------------------------------...
1,100,864
9.557
0.0005
19.4416
0.001
17.6956
0.0009
90
null
103.144
0.001
90
null
3,201.8
0.3
396
2
396
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C30 H48 Au2 Cl2 N4 -
- C30 H48 Au2 Cl2 N4 -
- C120 H192 Au8 Cl8 N16 -
4
1
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0386
0.0371
null
null
0.0881
0.0888
null
null
null
null
null
1.079
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100864.cif $ #-------------------------------------------------------------------...
1,100,865
14.5735
0.0007
11.7626
0.0006
12.9098
0.0006
90
null
111.449
0.001
90
null
2,059.76
0.17
150
2
150
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C23 H32 Au Cl N2 -
- C23 H32 Au Cl N2 -
- C92 H128 Au4 Cl4 N8 -
4
1
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0225
0.0207
null
null
0.0524
0.0535
null
null
null
null
null
1.096
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100865.cif $ #-------------------------------------------------------------------...
1,100,866
7.3539
0.0004
10.8603
0.0005
14.5517
0.0007
91.929
0.001
91.323
0.001
101.547
0.001
1,137.48
0.1
150
2
150
2
null
null
null
null
5
P -1
-P 1
2
- C11 H11 Au Cl N3 -
- C11 H11 Au Cl N3 -
- C44 H44 Au4 Cl4 N12 -
4
2
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P.
Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes
Organometallics
2,005
24
10
2411
2418
10.1021/om050111c
0.71073
MoKα
0.0218
0.0214
null
null
0.0634
0.0637
null
null
null
null
null
1.077
null
null
has coordinates
de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100866.cif $ #-------------------------------------------------------------------...
1,100,867
38.8057
0.0019
10.9768
0.0006
15.7674
0.0008
90
null
103.486
0.001
90
null
6,531.1
0.6
297
2
297
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
RuCl2(H2IMes)(=CH-Ph-CH=N-Ph)
- C35 H37 Cl2 N3 Ru -
- C35 H37 Cl2 N3 Ru -
- C280 H296 Cl16 N24 Ru8 -
8
1
Slugovc, Christian; Burtscher, Daniel; Stelzer, Franz; Mereiter, Kurt
Thermally Switchable Olefin Metathesis Initiators Bearing Chelating Carbenes: Influence of the Chelate's Ring Size
Organometallics
2,005
24
10
2255
2258
10.1021/om050141f
0.71073
MoKα
0.0742
0.0498
null
null
0.1207
0.1342
null
null
null
null
null
1.046
null
null
has coordinates,has disorder
Slugovc, Christian; Burtscher, Daniel; Stelzer, Franz; Mereiter, Kurt Thermally Switchable Olefin Metathesis Initiators Bearing Chelating Carbenes: Influence of the Chelate's Ring Size Organometallics 24(10) (2005) 2255-2258
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100867.cif $ #-------------------------------------------------------------------...
1,100,868
27.76
0.04
15.49
0.02
17.149
0.005
90
null
92.59
0.04
90
null
7,366
15
296
2
296
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
RuCl2(H2IMes)(=CH-Ph-N=CH-Ph).solv
- C35 H37 Cl2 N3 Ru -
- C37.489 H37 Cl2 N3 Ru -
- C299.912 H296 Cl16 N24 Ru8 -
8
1
Slugovc, Christian; Burtscher, Daniel; Stelzer, Franz; Mereiter, Kurt
Thermally Switchable Olefin Metathesis Initiators Bearing Chelating Carbenes: Influence of the Chelate's Ring Size
Organometallics
2,005
24
10
2255
2258
10.1021/om050141f
0.71073
MoKα
0.0996
0.0586
null
null
0.1214
0.1692
null
null
null
null
null
1.176
null
null
has coordinates
Slugovc, Christian; Burtscher, Daniel; Stelzer, Franz; Mereiter, Kurt Thermally Switchable Olefin Metathesis Initiators Bearing Chelating Carbenes: Influence of the Chelate's Ring Size Organometallics 24(10) (2005) 2255-2258
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100868.cif $ #-------------------------------------------------------------------...
1,100,869
9.5092
0.0001
17.3418
0.0002
18.1765
0.0002
69.709
0.0005
88.5567
0.0005
89.6242
0.0005
2,810.52
0.05
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
fac-[(2-methoxycarbonylethynil)tricarbonyl(bis(diphenylphosphanyl)methane) manganese(I)]
- C64 H50 Mn2 O10 P4 -
- C64 H50 Mn2 O10 P4 -
- C128 H100 Mn4 O20 P8 -
2
1
Ruiz, J.; Quesada, R.; Vivanco, M.; Castellano, E. E.; Piro, O. E.
Stepwise Formation of σ-Alkynyl, Vinylidene, and Vinylphosphonium Complexes of Manganese(I)
Organometallics
2,005
24
10
2542
2545
10.1021/om050146c
0.71073
MoKα
0.0394
0.032
null
null
0.0939
0.1016
null
null
null
null
null
1.038
null
null
has coordinates
Ruiz, J.; Quesada, R.; Vivanco, M.; Castellano, E. E.; Piro, O. E. Stepwise Formation of σ-Alkynyl, Vinylidene, and Vinylphosphonium Complexes of Manganese(I) Organometallics 24(10) (2005) 2542-2545
176,428
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176428 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100869.cif $ #-------------------------------------------------------------------...
1,100,870
10.2407
0.0002
16.6566
0.0004
18.3683
0.0004
90
null
95.65
0.001
90
null
3,118
0.1
100
2
100
2
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
fac-[tricarbonyl(2-methoxycarbonylvinyliden(diphenylphosphanylmethyl)diphenylphosphorane)maganese(I)] tetrafluoroborate
- C32 H26 B F4 Mn O5 P2 -
- C32 H26 B F4 Mn O5 P2 -
- C128 H104 B4 F16 Mn4 O20 P8 -
4
1
Ruiz, J.; Quesada, R.; Vivanco, M.; Castellano, E. E.; Piro, O. E.
Stepwise Formation of σ-Alkynyl, Vinylidene, and Vinylphosphonium Complexes of Manganese(I)
Organometallics
2,005
24
10
2542
2545
10.1021/om050146c
0.71073
MoKα
0.0472
0.0373
null
null
0.0945
0.101
null
null
null
null
null
1.045
null
null
has coordinates
Ruiz, J.; Quesada, R.; Vivanco, M.; Castellano, E. E.; Piro, O. E. Stepwise Formation of σ-Alkynyl, Vinylidene, and Vinylphosphonium Complexes of Manganese(I) Organometallics 24(10) (2005) 2542-2545
176,428
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176428 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100870.cif $ #-------------------------------------------------------------------...
1,100,871
42.11
0.005
10.6323
0.0009
20.577
0.002
90
null
117.67
0.006
90
null
8,159.4
1.4
163
null
163
null
null
null
null
null
7
C 1 2/c 1
-C 2yc
15
- C35 H51 F12 N O2 P2 W -
- C35 H51 F12 N O2 P2 W -
- C280 H408 F96 N8 O16 P16 W8 -
8
1
Jamison, Gregory M.; Wheeler, David R.; Loy, Douglas A.; Ziller, Joseph W.
Double Phosphaalkyne Insertion to a Tungsten Alkylidene: Formation of a Diphosphametallabicyclobutane
Organometallics
2,005
24
10
2245
2247
10.1021/om050150o
0.71073
MoKα
0.0467
0.0317
null
0.0714
0.065
null
null
null
1.06
1.085
1.085
null
null
null
has coordinates
Jamison, Gregory M.; Wheeler, David R.; Loy, Douglas A.; Ziller, Joseph W. Double Phosphaalkyne Insertion to a Tungsten Alkylidene: Formation of a Diphosphametallabicyclobutane Organometallics 24(10) (2005) 2245-2247
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100871.cif $ #-------------------------------------------------------------------...
1,100,872
14.6994
0.0004
17.0733
0.0005
18.7037
0.0006
113.789
0.001
93.112
0.001
95.302
0.001
4,255.2
0.2
123
2
123
2
null
null
null
null
4
P -1
-P 1
2
- C92 H134 N10 Sm2 -
- C92 H134 N10 Sm2 -
- C184 H268 N20 Sm4 -
2
1
Wang, Jun; Amos, Ruth I. J.; Frey, Alistair S. P.; Gardiner, Michael G.; Cole, Marcus L.; Junk, Peter C.
Reversible Sm(III)/Sm(II) Redox Chemistry of an Organosamarium(III) Complex
Organometallics
2,005
24
10
2259
2261
10.1021/om050172a
0.71073
MoKα
0.0821
0.0436
null
null
0.0935
0.1075
null
null
null
null
null
1.015
null
null
has coordinates
Wang, Jun; Amos, Ruth I. J.; Frey, Alistair S. P.; Gardiner, Michael G.; Cole, Marcus L.; Junk, Peter C. Reversible Sm(III)/Sm(II) Redox Chemistry of an Organosamarium(III) Complex Organometallics 24(10) (2005) 2259-2261
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100872.cif $ #-------------------------------------------------------------------...
1,100,873
12.6218
0.0005
13.3776
0.0005
14.3654
0.0005
92.678
0.001
91.051
0.001
109.958
0.001
2,275.91
0.15
293
2
293
2
null
null
null
null
6
P -1
-P 1
2
- C38 H42 O13 P Pt Ru5 -
- C38 H42 O13 P Pt Ru5 -
- C76 H84 O26 P2 Pt2 Ru10 -
2
1
Adams, Richard D.; Captain, Burjor; Zhu, Lei
Platinum Participation in the Hydrogenation of Phenylacetylene by Ru~5~(CO)~15~(C)[Pt(PBut~3~)]
Journal of the American Chemical Society
2,004
126
10
3042
3043
10.1021/ja049955y
0.71073
MoKα
0.0578
0.0454
null
null
0.1139
0.1227
null
null
null
null
null
1.037
null
null
has coordinates
Adams, Richard D.; Captain, Burjor; Zhu, Lei Platinum Participation in the Hydrogenation of Phenylacetylene by Ru~5~(CO)~15~(C)[Pt(PBut~3~)] Journal of the American Chemical Society 126(10) (2004) 3042-3043
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100873.cif $ #-------------------------------------------------------------------...
1,100,874
39.057
0.0013
18.0757
0.0006
22.9961
0.0007
90
null
126.005
0.001
90
null
13,133.4
0.7
296
2
296
2
null
null
null
null
6
C 1 2/c 1
-C 2yc
15
- C52 H74 O13 P2 Pt2 Ru5 -
- C52 H74 O13 P2 Pt2 Ru5 -
- C416 H592 O104 P16 Pt16 Ru40 -
8
1
Adams, Richard D.; Captain, Burjor; Zhu, Lei
New High Nuclearity Platinum‒Ruthenium Carbonyl Cluster Complexes Containing a Phenylacetylene Ligand: Structures and Properties
Organometallics
2,005
24
10
2419
2423
10.1021/om050175n
0.71073
MoKα
0.0731
0.0509
null
null
0.1155
0.124
null
null
null
null
null
1.095
null
null
has coordinates
Adams, Richard D.; Captain, Burjor; Zhu, Lei New High Nuclearity Platinum‒Ruthenium Carbonyl Cluster Complexes Containing a Phenylacetylene Ligand: Structures and Properties Organometallics 24(10) (2005) 2419-2423
180,566
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-28 20:40:01 +0300 (Mon, 28 Mar 2016) $ #$Revision: 180566 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100874.cif $ #-------------------------------------------------------------------...
1,100,875
14.7755
0.0008
16.3794
0.0009
17.372
0.001
80.34
0.001
66.324
0.001
71.645
0.001
3,650.4
0.4
293
2
293
2
null
null
null
null
6
P -1
-P 1
2
- C61 H90 O13 P3 Pt3 Ru5 -
- C61 H90 O13 P3 Pt3 Ru5 -
- C122 H180 O26 P6 Pt6 Ru10 -
2
1
Adams, Richard D.; Captain, Burjor; Zhu, Lei
New High Nuclearity Platinum‒Ruthenium Carbonyl Cluster Complexes Containing a Phenylacetylene Ligand: Structures and Properties
Organometallics
2,005
24
10
2419
2423
10.1021/om050175n
0.71073
MoKα
0.0673
0.0485
null
null
0.1275
0.1401
null
null
null
null
null
1.019
null
null
has coordinates
Adams, Richard D.; Captain, Burjor; Zhu, Lei New High Nuclearity Platinum‒Ruthenium Carbonyl Cluster Complexes Containing a Phenylacetylene Ligand: Structures and Properties Organometallics 24(10) (2005) 2419-2423
180,566
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-28 20:40:01 +0300 (Mon, 28 Mar 2016) $ #$Revision: 180566 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100875.cif $ #-------------------------------------------------------------------...
1,100,876
12.3343
0.001
12.6118
0.001
13.4358
0.0011
90
null
95.913
0.002
90
null
2,078.9
0.3
296
2
296
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C22 H30 Cl Os P -
- C22 H30 Cl Os P -
- C88 H120 Cl4 Os4 P4 -
4
1
Baya, Miguel; Buil, María L.; Esteruelas, Miguel A.; Oñate, Enrique
Ene-Type Reactions between an α-Alkenylphosphine and Terminal Alkynes Promoted by Osmium-Cyclopentadienyl Fragments
Organometallics
2,005
24
9
2030
2038
10.1021/om0489857
0.71073
MoKα
0.0576
0.0297
null
null
0.0365
0.0402
null
null
null
null
null
0.655
4,060,292
null
has coordinates
Baya, Miguel; Buil, María L.; Esteruelas, Miguel A.; Oñate, Enrique Ene-Type Reactions between an α-Alkenylphosphine and Terminal Alkynes Promoted by Osmium-Cyclopentadienyl Fragments Organometallics 24(9) (2005) 2030-2038
219,028
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2019-10-02 14:34:28 +0300 (Wed, 02 Oct 2019) $ #$Revision: 219028 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100876.cif $ #-------------------------------------------------------------------...
1,100,877
7.6298
0.0005
11.3416
0.0007
14.0086
0.0008
103.785
0.001
95.97
0.001
91.487
0.001
1,169.3
0.12
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
- C24.5 H34 Cl Os P -
- C24.5 H23 Cl Os P -
- C49 H46 Cl2 Os2 P2 -
2
1
Baya, Miguel; Buil, María L.; Esteruelas, Miguel A.; Oñate, Enrique
Ene-Type Reactions between an α-Alkenylphosphine and Terminal Alkynes Promoted by Osmium-Cyclopentadienyl Fragments
Organometallics
2,005
24
9
2030
2038
10.1021/om0489857
0.71073
MoKα
0.0321
0.0285
null
null
0.0627
0.0636
null
null
null
null
null
1.002
4,060,293
null
has coordinates,has disorder
Baya, Miguel; Buil, María L.; Esteruelas, Miguel A.; Oñate, Enrique Ene-Type Reactions between an α-Alkenylphosphine and Terminal Alkynes Promoted by Osmium-Cyclopentadienyl Fragments Organometallics 24(9) (2005) 2030-2038
219,028
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2019-10-02 14:34:28 +0300 (Wed, 02 Oct 2019) $ #$Revision: 219028 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100877.cif $ #-------------------------------------------------------------------...
1,100,878
14.12
0.004
24.452
0.007
11.08
0.003
90
null
90.92
0.02
90
null
3,825
2
153
2
153
2
null
null
null
null
4
C 1 2/c 1
-C 2yc
15
- C43 H33 O8 Ru3 -
- C43 H26 O8 Ru3 -
- C172 H104 O32 Ru12 -
4
0.5
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu.
Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone
Organometallics
2,005
24
10
2279
2288
10.1021/om0489958
0.71073
MoKα
0.0721
0.0367
null
null
0.0788
0.0827
null
null
null
null
null
0.917
null
null
has coordinates
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu. Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone Organometallics 24(10) (2005) 2279-2288
282,777
2023-04-20
11:56:41
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100878.cif $ #-------------------------------------------------------------------...
1,100,879
10.6747
0.0013
12.9415
0.0016
23.694
0.003
88.432
0.003
83.478
0.003
73.94
0.004
3,125.1
0.7
110
2
110
2
null
null
null
null
4
P -1
-P 1
2
- C75 H56 O11 Ru3 -
- C75 H56 O11 Ru3 -
- C150 H112 O22 Ru6 -
2
1
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu.
Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone
Organometallics
2,005
24
10
2279
2288
10.1021/om0489958
0.71073
MoKα
0.1234
0.0597
null
null
0.1071
0.1187
null
null
null
null
null
0.946
null
null
has coordinates
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu. Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone Organometallics 24(10) (2005) 2279-2288
282,777
2023-04-20
11:56:42
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100879.cif $ #-------------------------------------------------------------------...
1,100,880
10.4959
0.0017
12.347
0.002
12.762
0.002
75.86
0.003
83.084
0.003
76.385
0.003
1,555.2
0.4
110
2
110
2
null
null
null
null
4
P -1
-P 1
2
- C76 H56 O12 Ru4 -
- C76 H56 O12 Ru4 -
- C76 H56 O12 Ru4 -
1
0.5
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu.
Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone
Organometallics
2,005
24
10
2279
2288
10.1021/om0489958
0.71073
MoKα
0.0777
0.0437
null
null
0.1042
0.1227
null
null
null
null
null
0.986
null
null
has coordinates
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu. Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone Organometallics 24(10) (2005) 2279-2288
282,777
2023-04-20
11:56:42
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100880.cif $ #-------------------------------------------------------------------...
1,100,881
11.2554
0.0012
14.1456
0.0015
14.174
0.0015
65.566
0.002
80.367
0.002
70.567
0.002
1,936.4
0.4
110
2
110
2
null
null
null
null
4
P -1
-P 1
2
- C44 H40 O8 Ru2 -
- C44 H40 O8 Ru2 -
- C88 H80 O16 Ru4 -
2
1
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu.
Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone
Organometallics
2,005
24
10
2279
2288
10.1021/om0489958
0.71073
MoKα
0.0729
0.0514
null
null
0.1139
0.1225
null
null
null
null
null
1.045
null
null
has coordinates
Osintseva, Svetlana V.; Dolgushin, Fedor M.; Shtel'tser, Nikolay A.; Petrovskii, Pavel V.; Kreindlin, Arkadii Z.; Rybin, Leonid V.; Antipin, Mikhail Yu. Reaction of Ru <sub>3</sub> (CO) <sub>12</sub> with Dibenzylideneacetone Organometallics 24(10) (2005) 2279-2288
282,777
2023-04-20
11:56:42
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100881.cif $ #-------------------------------------------------------------------...
1,100,882
9.4016
0.0017
9.5304
0.0016
22.771
0.004
93.146
0.004
92.938
0.004
98.53
0.004
2,011.1
0.6
173
2
173
2
null
null
null
null
6
P -1
-P 1
2
- C41.5 H52 N2 P2 Si2 Y -
- C41.5 H47 N2 P2 Si2 Y -
- C83 H94 N4 P4 Si4 Y2 -
2
1
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
Organometallics
2,005
24
9
2197
2202
10.1021/om0491138
0.71073
MoKα
0.0465
0.0341
null
null
0.0875
0.0949
null
null
null
null
null
1.064
4,060,417
null
has coordinates
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W. Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis Organometallics 24(9) (2005) 2197-2202
180,535
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-27 05:05:50 +0300 (Sun, 27 Mar 2016) $ #$Revision: 180535 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100882.cif $ #-------------------------------------------------------------------...
7,015,138
12.3218
0.0012
13.9301
0.0013
18.273
0.002
77.021
0.008
81.07
0.008
71.718
0.007
2,889.8
0.5
293
2
293
2
null
null
null
null
8
P -1
-P 1
2
- C47 H89 Cl Li Lu N4 O3 Si4 -
- C47 H65 Cl Li Lu N4 O3 Si4 -
- C94 H130 Cl2 Li2 Lu2 N8 O6 Si8 -
2
1
Luo, Yunjie; Fan, Shimin; Yang, Jianping; Fang, Jianghua; Xu, Ping
Rare earth metal bis(amide) complexes bearing amidinate ancillary ligands: synthesis, characterization, and performance as catalyst precursors for cis-1,4 selective polymerization of isoprene.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3053
3059
10.1039/c0dt01241f
0.7107
MoKα
0.0721
0.0584
null
null
0.1367
0.149
null
null
null
null
null
1.078
null
null
has coordinates,has disorder
Luo, Yunjie; Fan, Shimin; Yang, Jianping; Fang, Jianghua; Xu, Ping Rare earth metal bis(amide) complexes bearing amidinate ancillary ligands: synthesis, characterization, and performance as catalyst precursors for cis-1,4 selective polymerization of isoprene. Dalton transactions (Cambridge, England : 2003) 40(12) (2011...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015138.cif $ #-------------------------------------------------------------------...
1,100,883
12.305
0.0008
19.623
0.0013
15.65
0.001
90
null
99.364
0.008
90
null
3,728.5
0.4
203
2
203
2
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
- C39 H47 N2 P2 Si2 Sm -
- C39 H47 N2 P2 Si2 Sm -
- C156 H188 N8 P8 Si8 Sm4 -
4
1
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
Organometallics
2,005
24
9
2197
2202
10.1021/om0491138
0.56087
AgKα
0.0721
0.0585
null
null
0.1619
0.1742
null
null
null
null
null
1.12
4,060,418
null
has coordinates
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W. Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis Organometallics 24(9) (2005) 2197-2202
180,535
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-27 05:05:50 +0300 (Sun, 27 Mar 2016) $ #$Revision: 180535 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100883.cif $ #-------------------------------------------------------------------...
1,100,884
9.3791
0.0017
9.4895
0.0017
22.693
0.004
93.345
0.004
92.875
0.004
98.921
0.004
1,988.3
0.6
173
2
173
2
null
null
null
null
6
P -1
-P 1
2
- C41.5 H52 Er N2 P2 Si2 -
- C41.5 H47 Er N2 P2 Si2 -
- C83 H94 Er2 N4 P4 Si4 -
2
1
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
Organometallics
2,005
24
9
2197
2202
10.1021/om0491138
0.71073
MoKα
0.033
0.0262
null
null
0.0607
0.0653
null
null
null
null
null
1.065
4,060,419
null
has coordinates
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W. Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis Organometallics 24(9) (2005) 2197-2202
180,535
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-27 05:05:50 +0300 (Sun, 27 Mar 2016) $ #$Revision: 180535 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100884.cif $ #-------------------------------------------------------------------...
1,100,885
9.377
0.002
9.508
0.002
22.703
0.005
93.493
0.004
92.759
0.004
99.268
0.004
1,990.6
0.7
173
2
173
2
null
null
null
null
6
P -1
-P 1
2
- C41.5 H52 N2 P2 Si2 Yb -
- C41.5 H47 N2 P2 Si2 Yb -
- C83 H94 N4 P4 Si4 Yb2 -
2
1
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
Organometallics
2,005
24
9
2197
2202
10.1021/om0491138
0.71073
MoKα
0.0326
0.0265
null
null
0.0621
0.067
null
null
null
null
null
1.068
4,060,420
null
has coordinates
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W. Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis Organometallics 24(9) (2005) 2197-2202
180,535
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-27 05:05:50 +0300 (Sun, 27 Mar 2016) $ #$Revision: 180535 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100885.cif $ #-------------------------------------------------------------------...
1,100,886
9.351
0.002
9.5
0.002
22.7
0.005
93.619
0.005
92.852
0.005
99.437
0.005
1,981.7
0.7
173
2
173
2
null
null
null
null
6
P -1
-P 1
2
- C41.5 H52 Lu N2 P2 Si2 -
- C41.5 H47 Lu N2 P2 Si2 -
- C83 H94 Lu2 N4 P4 Si4 -
2
1
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
Organometallics
2,005
24
9
2197
2202
10.1021/om0491138
0.71073
MoKα
0.0275
0.0237
null
null
0.0565
0.0605
null
null
null
null
null
1.082
4,060,421
null
has coordinates
Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W. Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis Organometallics 24(9) (2005) 2197-2202
180,535
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-27 05:05:50 +0300 (Sun, 27 Mar 2016) $ #$Revision: 180535 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100886.cif $ #-------------------------------------------------------------------...
1,100,887
7.265
0.003
11.059
0.004
22.303
0.008
90
null
91.824
0.005
90
null
1,791.2
1
168
2
null
null
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
- C26 H18 Fe -
- C26 H18 Fe -
- C104 H72 Fe4 -
4
1
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim
Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads
Organometallics
2,005
24
9
2051
2060
10.1021/om0492653
null
0.0608
0.0423
null
null
0.101
0.1075
null
null
null
null
null
0.919
null
null
has coordinates
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
209,832
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-08-17 01:36:00 +0300 (Fri, 17 Aug 2018) $ #$Revision: 209832 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100887.cif $ #-------------------------------------------------------------------...
1,100,888
7.81
0.005
9.956
0.006
13.205
0.008
107.54
0.006
101.733
0.007
100.521
0.006
925.4
1
163
2
163
2
null
null
null
null
3
P -1
-P 1
2
- C28 H18 Fe -
- C28 H18 Fe -
- C56 H36 Fe2 -
2
1
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim
Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads
Organometallics
2,005
24
9
2051
2060
10.1021/om0492653
0.71073
MoKα
0.0515
0.0374
null
null
0.0894
0.093
null
null
null
null
null
0.966
null
null
has coordinates
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
209,832
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-08-17 01:36:00 +0300 (Fri, 17 Aug 2018) $ #$Revision: 209832 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100888.cif $ #-------------------------------------------------------------------...
1,100,889
11.421
0.001
10.868
0.001
17.2066
0.0016
90
null
99.609
0.001
90
null
2,105.8
0.3
158
2
158
2
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
- C32 H20 Fe -
- C32 H20 Fe -
- C128 H80 Fe4 -
4
1
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim
Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads
Organometallics
2,005
24
9
2051
2060
10.1021/om0492653
0.71073
MoKα
0.0891
0.0754
null
null
0.2192
0.2279
null
null
null
null
null
1.066
null
null
has coordinates
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
209,832
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-08-17 01:36:00 +0300 (Fri, 17 Aug 2018) $ #$Revision: 209832 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100889.cif $ #-------------------------------------------------------------------...
1,100,890
7.7278
0.0004
10.5188
0.0009
12.0885
0.0008
101.449
0.005
100.901
0.004
95.453
0.005
936.69
0.11
294
2
294
2
null
null
null
null
3
P -1
-P 1
2
- C26 H20 Fe -
- C26 H20 Fe -
- C52 H40 Fe2 -
2
1
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim
Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads
Organometallics
2,005
24
9
2051
2060
10.1021/om0492653
0.71073
MoKα
0.0436
0.0345
null
null
0.0905
0.1033
null
null
null
null
null
0.613
null
null
has coordinates,has disorder
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
209,832
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-08-17 01:36:00 +0300 (Fri, 17 Aug 2018) $ #$Revision: 209832 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100890.cif $ #-------------------------------------------------------------------...
1,100,891
19.12
0.03
7.379
0.009
14.89
0.03
90
null
110.62
0.03
90
null
1,966
5
168
2
168
2
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
(E)-1-ferrocenyl-2-(1-pyrenyl) ethene
- C28 H20 Fe -
- C28 H20 Fe -
- C112 H80 Fe4 -
4
1
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim
Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads
Organometallics
2,005
24
9
2051
2060
10.1021/om0492653
0.71073
MoKα
0.102
0.0363
null
null
0.0594
0.0696
null
null
null
null
null
0.829
null
null
has coordinates
Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
209,832
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-08-17 01:36:00 +0300 (Fri, 17 Aug 2018) $ #$Revision: 209832 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100891.cif $ #-------------------------------------------------------------------...
7,015,137
12.393
0.006
13.632
0.008
15.539
0.008
104.788
0.014
108.411
0.006
100.221
0.013
2,311
2
293
2
293
2
null
null
null
null
5
P -1
-P 1
2
- C38 H72 N4 Si4 Y -
- C38 H65 N4 Si4 Y -
- C76 H130 N8 Si8 Y2 -
2
1
Luo, Yunjie; Fan, Shimin; Yang, Jianping; Fang, Jianghua; Xu, Ping
Rare earth metal bis(amide) complexes bearing amidinate ancillary ligands: synthesis, characterization, and performance as catalyst precursors for cis-1,4 selective polymerization of isoprene.
Dalton transactions (Cambridge, England : 2003)
2,011
40
12
3053
3059
10.1039/c0dt01241f
0.7107
MoKα
0.1043
0.079
null
null
0.1641
0.1781
null
null
null
null
null
1.117
null
null
has coordinates
Luo, Yunjie; Fan, Shimin; Yang, Jianping; Fang, Jianghua; Xu, Ping Rare earth metal bis(amide) complexes bearing amidinate ancillary ligands: synthesis, characterization, and performance as catalyst precursors for cis-1,4 selective polymerization of isoprene. Dalton transactions (Cambridge, England : 2003) 40(12) (2011...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015137.cif $ #-------------------------------------------------------------------...
1,100,892
6.0387
0.0001
32.3369
0.0005
15.9373
0.0002
90
null
103.062
0.0006
90
null
3,031.6
0.08
125
2
125
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C32 H8 F20 O0.18 P2 -
- C32 H8 F20 O0.18 P2 -
- C128 H32 F80 O0.72 P8 -
4
1
Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard
Electron-Poor Pentafluorophenyl-Substituted PCP–Palladium Pincer Complexes
Organometallics
2,005
24
9
2016
2019
10.1021/om0500063
0.71073
MoKα
0.0615
0.0381
null
null
0.0929
0.1046
null
null
null
null
null
1.072
null
null
has coordinates
Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard Electron-Poor Pentafluorophenyl-Substituted PCP–Palladium Pincer Complexes Organometallics 24(9) (2005) 2016-2019
301,773
2025-08-18
12:42:42
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:40:47 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301773 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100892.cif $ #-------------------------------------------------------------------...
1,100,893
10.1565
0.0002
25.6619
0.0005
16.1795
0.0003
90
null
110.544
0.0008
90
null
3,948.77
0.13
150
2
150
2
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
- C34 H10 B F24 N P2 Pd -
- C34 H10 B F24 N P2 Pd -
- C136 H40 B4 F96 N4 P8 Pd4 -
4
1
Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard
Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes
Organometallics
2,005
24
9
2016
2019
10.1021/om0500063
0.71073
MoKα
0.0577
0.0407
null
null
0.0931
0.1001
null
null
null
null
null
1.04
null
null
has coordinates,has disorder
Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes Organometallics 24(9) (2005) 2016-2019
210,323
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-09-01 22:50:30 +0300 (Sat, 01 Sep 2018) $ #$Revision: 210323 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100893.cif $ #-------------------------------------------------------------------...
1,100,894
15.4853
0.0001
13.6515
0.0001
26.0274
0.0002
90
null
122.559
0.0003
90
null
4,637.39
0.06
150
2
150
2
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
- C46.7 H23.8 Cl F20 P2 Pd -
- C46.7 H23.8 Cl F20 P2 Pd -
- C186.8 H95.2 Cl4 F80 P8 Pd4 -
4
1
Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard
Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes
Organometallics
2,005
24
9
2016
2019
10.1021/om0500063
0.71073
MoKα
0.0542
0.043
null
null
0.1286
0.1381
null
null
null
null
null
1.06
null
null
has coordinates,has disorder
Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes Organometallics 24(9) (2005) 2016-2019
210,323
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-09-01 22:50:30 +0300 (Sat, 01 Sep 2018) $ #$Revision: 210323 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100894.cif $ #-------------------------------------------------------------------...
1,100,895
16.8425
0.0003
21.51
0.0004
36.4135
0.0007
90
null
100.741
0.0006
90
null
12,960.8
null
150
null
150
null
null
null
null
null
7
P 1 21/n 1
-P 2yn
14
[Nb(NtBu){MeC(2-C5H4N)(CH2NSiMe3)(CH2NC(OSiMe3)NtBu)}Cl]
- C24 H47 Cl N5 Nb O Si2 -
- C24 H47 Cl N5 Nb O Si2 -
- C384 H752 Cl16 N80 Nb16 O16 Si32 -
16
4
Ward, Benjamin D.; Orde, Gavin; Clot, Eric; Cowley, Andrew R.; Gade, Lutz H.; Mountford, Philip
Reactions of Neutral and Cationic Diamide-Supported Imido Complexes with CO <sub>2</sub> and Other Heterocumulenes: Issues of Site Selectivity
Organometallics
2,005
24
10
2368
2385
10.1021/om0500265
0.71073
MoKα
null
0.0433
null
null
null
0.0501
null
null
null
null
null
1.0441
null
null
has coordinates
Ward, Benjamin D.; Orde, Gavin; Clot, Eric; Cowley, Andrew R.; Gade, Lutz H.; Mountford, Philip Reactions of Neutral and Cationic Diamide-Supported Imido Complexes with CO <sub>2</sub> and Other Heterocumulenes: Issues of Site Selectivity Organometallics 24(10) (2005) 2368-2385
282,777
2023-04-20
11:56:42
#------------------------------------------------------------------------------ #$Date: 2023-04-20 14:53:48 +0300 (Thu, 20 Apr 2023) $ #$Revision: 282777 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100895.cif $ #-------------------------------------------------------------------...
1,100,896
8.6482
0.0008
10.7943
0.001
11.8122
0.0011
64.442
0.001
75.631
0.002
88.124
0.002
960.17
0.15
100
2
100
2
null
null
null
null
5
P -1
-P 1
2
- C21 H26 Br Ir N2 -
- C21 H26 Br Ir N2 -
- C42 H52 Br2 Ir2 N4 -
2
1
Hahn, F. Ekkehardt; Holtgrewe, Christian; Pape, Tania; Martin, Marta; Sola, Eduardo; Oro, Luis A.
Iridium Complexes with N-Allyl-Substituted Benzimidazol-2-ylidene Ligands and Their Application in Catalytic Transfer Hydrogenation
Organometallics
2,005
24
9
2203
2209
10.1021/om0500873
0.71073
MoKα
0.0227
0.0198
null
null
0.0375
0.038
null
null
null
null
null
0.942
4,060,534
null
has coordinates
Hahn, F. Ekkehardt; Holtgrewe, Christian; Pape, Tania; Martin, Marta; Sola, Eduardo; Oro, Luis A. Iridium Complexes with N-Allyl-Substituted Benzimidazol-2-ylidene Ligands and Their Application in Catalytic Transfer Hydrogenation Organometallics 24(9) (2005) 2203-2209
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100896.cif $ #-------------------------------------------------------------------...
1,100,897
29.6219
0.0012
10.7321
0.0004
17.8342
0.0007
90
null
97.589
0.001
90
null
5,619.9
0.4
100
2
100
2
null
null
null
null
7
C 1 2/c 1
-C 2yc
15
- C23 H28 B Cl6 F4 Ir N2 -
- C23 H28 B Cl6 F4 Ir N2 -
- C184 H224 B8 Cl48 F32 Ir8 N16 -
8
1
Hahn, F. Ekkehardt; Holtgrewe, Christian; Pape, Tania; Martin, Marta; Sola, Eduardo; Oro, Luis A.
Iridium Complexes with N-Allyl-Substituted Benzimidazol-2-ylidene Ligands and Their Application in Catalytic Transfer Hydrogenation
Organometallics
2,005
24
9
2203
2209
10.1021/om0500873
0.71073
MoKα
0.0312
0.0231
null
null
0.0356
0.0367
null
null
null
null
null
0.851
4,060,535
null
has coordinates
Hahn, F. Ekkehardt; Holtgrewe, Christian; Pape, Tania; Martin, Marta; Sola, Eduardo; Oro, Luis A. Iridium Complexes with N-Allyl-Substituted Benzimidazol-2-ylidene Ligands and Their Application in Catalytic Transfer Hydrogenation Organometallics 24(9) (2005) 2203-2209
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100897.cif $ #-------------------------------------------------------------------...
1,100,898
34.958
0.003
7.5715
0.0006
17.765
0.0014
90
null
98.403
0.002
90
null
4,651.6
0.6
173
2
173
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
- C28 H34 Br Ir N2 -
- C24.5 H30.02 Br Ir N2 -
- C196 H240.16 Br8 Ir8 N16 -
8
1
Hahn, F. Ekkehardt; Holtgrewe, Christian; Pape, Tania; Martin, Marta; Sola, Eduardo; Oro, Luis A.
Iridium Complexes with N-Allyl-Substituted Benzimidazol-2-ylidene Ligands and Their Application in Catalytic Transfer Hydrogenation
Organometallics
2,005
24
9
2203
2209
10.1021/om0500873
0.71073
MoKα
0.0453
0.0339
null
null
0.0729
0.0771
null
null
null
null
null
1.016
4,060,536
null
has coordinates,has disorder
Hahn, F. Ekkehardt; Holtgrewe, Christian; Pape, Tania; Martin, Marta; Sola, Eduardo; Oro, Luis A. Iridium Complexes with N-Allyl-Substituted Benzimidazol-2-ylidene Ligands and Their Application in Catalytic Transfer Hydrogenation Organometallics 24(9) (2005) 2203-2209
210,322
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-09-01 22:43:12 +0300 (Sat, 01 Sep 2018) $ #$Revision: 210322 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100898.cif $ #-------------------------------------------------------------------...
1,100,899
11.4596
0.0005
12.0029
0.0005
16.3524
0.0007
78.569
0.001
89.576
0.001
75.536
0.001
2,132.65
0.16
150
2
150
2
null
null
null
null
6
P -1
-P 1
2
- C35.5 H69 Ge N2 P2 Si4 -
- C35 H68 Ge N2 P2 Si4 -
- C70 H136 Ge2 N4 P4 Si8 -
2
1
Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W.
An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study
Organometallics
2,005
24
9
2157
2167
10.1021/om0501125
0.71073
MoKα
0.0299
0.0268
null
null
0.0755
0.0776
null
null
null
null
null
1.036
null
null
has coordinates
Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W. An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study Organometallics 24(9) (2005) 2157-2167
210,321
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-09-01 22:33:33 +0300 (Sat, 01 Sep 2018) $ #$Revision: 210321 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/08/1100899.cif $ #-------------------------------------------------------------------...
1,100,900
48.748
0.003
11.2312
0.0006
11.141
0.0006
90
null
90
null
90
null
6,099.7
0.6
160
2
160
2
null
null
null
null
9
P n a 21
P 2c -2n
33
- C44 H92 Ge I2 Li2 N2 O3 P2 Si4 -
- C44 H92 Ge I2 Li2 N2 O3 P2 Si4 -
- C176 H368 Ge4 I8 Li8 N8 O12 P8 Si16 -
4
1
Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W.
An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study
Organometallics
2,005
24
9
2157
2167
10.1021/om0501125
0.71073
MoKα
0.0581
0.0476
null
null
0.0965
0.0998
null
null
null
null
null
1.106
null
null
has coordinates,has disorder
Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W. An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study Organometallics 24(9) (2005) 2157-2167
301,773
2025-08-18
12:42:42
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:40:47 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301773 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100900.cif $ #-------------------------------------------------------------------...
1,100,901
23.4873
0.0005
23.4873
0.0005
23.4873
0.0005
90
null
90
null
90
null
12,956.8
0.5
150
2
150
2
null
null
null
null
7
P a -3
-P 2ac 2ab 3
205
- C48 H93 Ge K N3 P3 Si6 -
- C48 H93 Ge K N3 P3 Si6 -
- C384 H744 Ge8 K8 N24 P24 Si48 -
8
0.333333
Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W.
An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study
Organometallics
2,005
24
9
2157
2167
10.1021/om0501125
0.71073
MoKα
0.0548
0.0402
null
null
0.1185
0.1358
null
null
null
null
null
1.167
null
null
has coordinates
Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W. An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study Organometallics 24(9) (2005) 2157-2167
301,773
2025-08-18
12:42:42
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:40:47 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301773 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100901.cif $ #-------------------------------------------------------------------...
1,100,902
9.814
0.004
9.861
0.004
11.505
0.005
101.19
0.03
111.44
0.04
101.37
0.03
971.9
0.7
243.1
null
null
null
null
null
null
null
5
P -1
-P 1
2
- C17 H27 Cl2 N2 V -
- C17 H27 Cl2 N2 V -
- C34 H54 Cl4 N4 V2 -
2
1
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro
A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP)
Organometallics
2,005
24
10
2248
2250
10.1021/om0501834
0.7107
MoKα
null
0.036
null
null
null
0.045
null
null
null
null
null
1.056
null
null
has coordinates
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP) Organometallics 24(10) (2005) 2248-2250
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100902.cif $ #-------------------------------------------------------------------...
1,100,903
9.838
0.001
12.565
0.002
20.509
0.003
90
null
95.857
0.004
90
null
2,521.9
0.6
243.1
null
null
null
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
- C20 H36 Cl2 N2 P V -
- C20 H36 Cl2 N2 P V -
- C80 H144 Cl8 N8 P4 V4 -
4
1
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro
A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP)
Organometallics
2,005
24
10
2248
2250
10.1021/om0501834
0.7107
MoKα
null
0.057
null
null
null
0.068
null
null
null
null
null
1.064
null
null
has coordinates
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP) Organometallics 24(10) (2005) 2248-2250
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100903.cif $ #-------------------------------------------------------------------...
1,100,904
29.52
0.003
10.9241
0.0005
18.578
0.001
90
null
109.683
0.003
90
null
5,641
0.7
243.1
null
null
null
null
null
null
null
6
C 1 2/c 1
-C 2yc
15
- C23 H43 Cl2 N2 P2 V -
- C23 H43 Cl2 N2 P2 V -
- C184 H344 Cl16 N16 P16 V8 -
8
1
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro
A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP)
Organometallics
2,005
24
10
2248
2250
10.1021/om0501834
0.7107
MoKα
null
0.043
null
null
null
0.048
null
null
null
null
null
1.094
null
null
has coordinates
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP) Organometallics 24(10) (2005) 2248-2250
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100904.cif $ #-------------------------------------------------------------------...
1,100,905
10.554
0.002
10.944
0.002
13.145
0.003
98.745
0.008
92.067
0.009
98.33
0.01
1,482.2
0.5
243.1
null
null
null
null
null
null
null
6
P -1
-P 1
2
- C24 H46 N2 P Si V -
- C24 H46 N2 P Si V -
- C48 H92 N4 P2 Si2 V2 -
2
1
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro
A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP)
Organometallics
2,005
24
10
2248
2250
10.1021/om0501834
0.7107
MoKα
null
0.054
null
null
null
0.067
null
null
null
null
null
1.02
null
null
has coordinates
Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP) Organometallics 24(10) (2005) 2248-2250
277,831
2022-09-14
14:31:32
#------------------------------------------------------------------------------ #$Date: 2022-09-14 17:31:13 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277831 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100905.cif $ #-------------------------------------------------------------------...
1,100,906
8.9463
0.0001
21.7605
0.0001
19.0038
0.0002
90
null
100.69
0.001
90
null
3,635.38
0.06
293
2
293
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C42 H30 N4 Ni S4 -
- C42 H30 N4 Ni S4 -
- C168 H120 N16 Ni4 S16 -
4
1
Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Wu, Ji; Tian, Yu-Peng; Xie, Fu-Xin; Shao, Ze-Huai; Li, Sheng-Li
Intra- and intermolecular C—H...π interactions in bis[benzyl 3-(fluoren-9-ylidene)dithiocarbazato-N^3^,S]nickel(II)
Acta Crystallographica, Section C: Crystal Structure Communications
2,000
56
11
1321
1322
10.1107/s0108270100011628
0.71073
MoKα
0.082
0.064
null
null
null
0.111
null
null
null
null
null
0.964
2,011,575
null
has coordinates
Shanmuga Sundara Raj, S.; Fun, Hoong-Kun; Wu, Ji; Tian, Yu-Peng; Xie, Fu-Xin; Shao, Ze-Huai; Li, Sheng-Li Intra- and intermolecular C—H...π interactions in bis[benzyl 3-(fluoren-9-ylidene)dithiocarbazato-N^3^,S]nickel(II) Acta Crystallographica, Section C: Crystal Structure Communications 56(11) (2000) 1321-1322
218,380
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2019-09-17 16:20:54 +0300 (Tue, 17 Sep 2019) $ #$Revision: 218380 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100906.cif $ #-------------------------------------------------------------------...
1,100,907
10.7589
0.0009
17.8696
0.0017
22.667
0.0018
90
null
90
null
90
null
4,357.9
0.7
294
1
294
1
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
(2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acidd
- C17 H15 N O4 -
- C17 H15 N O4 -
- C204 H180 N12 O48 -
12
3
Brady, Fiona; Gallagher, John F.
Intermolecular O-H...O hydrogen bonding in the three independent molecules of (2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acid
Acta Crystallographica, Section C
2,000
56
1407
1410
10.1107/S010827010001163X
0.7107
MoKα
0.086
0.045
null
null
null
0.116
null
null
null
null
null
1.02
null
null
has coordinates
Brady, Fiona; Gallagher, John F. Intermolecular O-H...O hydrogen bonding in the three independent molecules of (2S)-3-(4-hydroxyphenyl)-2-(1-oxoisoindolin-2-yl)propanoic acid Acta Crystallographica, Section C 56 (2000) 1407-1410
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/1/10/09/1100907.cif $ #-------------------------------------------------------------------...
1,100,908
15.922
0.002
5.7331
0.0008
21.341
0.003
90
null
91.097
0.011
90
null
1,947.6
0.5
293
2
293
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Aqua-bis(trans-2-butenoate)- bis(pyridine)copper(II)
- C18 H22 Cu N2 O5 -
- C18 H22 Cu N2 O5 -
- C72 H88 Cu4 N8 O20 -
4
0.5
Baggio, Ricardo; Foxman, Bruce; Garland, Maria Teresa; Perec, Mireille; Shang, Wen
Aquabis(crotonato)bis(pyridine)copper(II)
Acta Crystallographica Section C
2,000
56
11
e505
e506
10.1107/S0108270100013937
0.71073
MoKα
0.041
0.031
null
null
null
0.082
null
null
null
null
null
1.068
null
null
has coordinates,has Fobs
Baggio, Ricardo; Foxman, Bruce; Garland, Maria Teresa; Perec, Mireille; Shang, Wen Aquabis(crotonato)bis(pyridine)copper(II) Acta Crystallographica Section C 56(11) (2000) e505-e506
301,773
2025-08-18
12:42:42
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:40:47 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301773 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100908.cif $ #-------------------------------------------------------------------...
1,100,909
8.849
0.0018
9.206
0.0013
9.8438
0.0019
63.196
0.014
76.908
0.015
73.937
0.013
683
0.2
293
2
293
2
null
null
null
null
4
P -1
-P 1
2
N-(4-Methylphenyl)-N-2-propynyl-N-5-nitro-2-furfurylamine
- C15 H14 N2 O3 -
- C15 H14 N2 O3 -
- C30 H28 N4 O6 -
2
1
Hergold-Brundić, Antonija; Pavlović, Gordana; Mance, Ana Dunja; Jakopčić, Krešimir
N-(4-Methylphenyl)-N-(5-nitrofurfuryl)-N-prop-2-ynylamine
Acta Crystallographica, Section C: Crystal Structure Communications
2,000
56
11
e520
e521
10.1107/s0108270100013068
0.71073
MoKα
0.078
0.039
null
null
null
0.101
null
null
null
null
null
0.973
2,011,566
null
has coordinates,has Fobs
Hergold-Brundić, Antonija; Pavlović, Gordana; Mance, Ana Dunja; Jakopčić, Krešimir N-(4-Methylphenyl)-N-(5-nitrofurfuryl)-N-prop-2-ynylamine Acta Crystallographica, Section C: Crystal Structure Communications 56(11) (2000) e520-e521
180,616
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-30 15:18:45 +0300 (Wed, 30 Mar 2016) $ #$Revision: 180616 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100909.cif $ #-------------------------------------------------------------------...
1,100,910
7.496
0.001
6.308
0.001
10.125
0.002
90
null
100.11
0.01
90
null
471.32
0.13
293
2
293
2
null
null
null
null
4
P 1 21/m 1
-P 2yb
11
Bismuth(V)iron(III) oxophosphate
Bismuth(V) iron(III) tris(phosphate) oxide
- Bi0.4 Fe3 O13 P3 -
- Bi0.4 Fe3 O13 P3 -
- Bi0.8 Fe6 O26 P6 -
2
0.5
Benabad, Aicha; Bakhous, Karima; Cherkaoui, Fatima; Holt, Elizabeth M.
Bismuth(V) iron(III) tris(phosphate) oxide
Acta Crystallographica, Section C
2,000
56
1292
1293
10.1107/S010827010000977X
0.71073
MoKα
0.099
0.058
null
null
null
0.128
null
null
null
null
null
0.835
null
null
has coordinates
Benabad, Aicha; Bakhous, Karima; Cherkaoui, Fatima; Holt, Elizabeth M. Bismuth(V) iron(III) tris(phosphate) oxide Acta Crystallographica, Section C 56 (2000) 1292-1293
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/1/10/09/1100910.cif $ #-------------------------------------------------------------------...
1,100,911
6.207
0.003
11.915
0.005
15.583
0.006
90
null
90
null
90
null
1,152.5
0.9
293
2
293
2
null
null
null
null
6
P n n m
-P 2 2n
58
Sodium nitroprusside, deuterated
disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)
- C5 D4 Fe N6 Na2 O3 -
- C5 D4 Fe N6 Na2 O3 -
- C20 D16 Fe4 N24 Na8 O12 -
4
0.5
Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.
Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction
Acta Crystallographica, Section C
2,000
56
1289
1291
10.1107/S0108270100008763
0.71073
MoKα
0.02
0.019
null
null
null
0.051
null
null
null
null
null
1.227
null
null
has coordinates
Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N. Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction Acta Crystallographica, Section C 56 (2000) 1289-1291
277,833
2022-09-14
15:22:10
#------------------------------------------------------------------------------ #$Date: 2022-09-14 18:21:52 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277833 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100911.cif $ #-------------------------------------------------------------------...
7,015,136
9.224
0.002
9.643
0.002
10.015
0.002
65.055
0.004
80.203
0.004
67.057
0.004
743.8
0.3
291
2
291
2
null
null
null
null
5
P -1
-P 1
2
- C18 H34 Co2 O27 Zn2 -
- C18 H34 Co2 O27 Zn2 -
- C18 H34 Co2 O27 Zn2 -
1
0.5
Huang, Liang-Fang; Ji, Chang-Chun; Lu, Zhen-Zhong; Yao, Xiao-Qiang; Hu, Jin-Song; Zheng, He-Gen
Isomorphic coordination polymers of cobalt(II), zinc(II) with a flexible ligand of cis,cis,cis-1,2,3,4-cyclopentanetetracarboxylic acid and their molecular alloys: crystal structures, thermal decomposition mechanisms and magnetic properties.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3183
3190
10.1039/c0dt01230k
0.71073
MoKα
0.0618
0.0496
null
null
0.122
0.1275
null
null
null
null
null
1.016
null
null
has coordinates
Huang, Liang-Fang; Ji, Chang-Chun; Lu, Zhen-Zhong; Yao, Xiao-Qiang; Hu, Jin-Song; Zheng, He-Gen Isomorphic coordination polymers of cobalt(II), zinc(II) with a flexible ligand of cis,cis,cis-1,2,3,4-cyclopentanetetracarboxylic acid and their molecular alloys: crystal structures, thermal decomposition mechanisms and mag...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015136.cif $ #-------------------------------------------------------------------...
1,100,912
6.124
0.002
11.837
0.005
15.547
0.006
90
null
90
null
90
null
1,127
0.7
11
1
11
2
null
null
null
null
6
P n n m
-P 2 2n
58
Sodium nitroprusside, deuterated
disodium pentacyanonitrosylferrate(III) bis(dideuterium oxide)
- C5 D4 Fe N6 Na2 O3 -
- C5 D4 Fe N6 Na2 O3 -
- C20 D16 Fe4 N24 Na8 O12 -
4
0.5
Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N.
Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction
Acta Crystallographica, Section C
2,000
56
1289
1291
10.1107/S0108270100008763
0.71073
MoKα
0.025
0.02
null
null
null
0.054
null
null
null
null
null
1.081
null
null
has coordinates
Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N. Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction Acta Crystallographica, Section C 56 (2000) 1289-1291
277,833
2022-09-14
15:22:10
#------------------------------------------------------------------------------ #$Date: 2022-09-14 18:21:52 +0300 (Wed, 14 Sep 2022) $ #$Revision: 277833 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/09/1100912.cif $ #-------------------------------------------------------------------...