file
int64
a
float64
siga
float64
b
float64
sigb
float64
c
float64
sigc
float64
alpha
float64
sigalpha
float64
beta
float64
sigbeta
float64
gamma
float64
siggamma
float64
vol
float64
sigvol
float64
celltemp
float64
sigcelltemp
float64
diffrtemp
float64
sigdiffrtemp
float64
cellpressure
float64
sigcellpressure
float64
diffrpressure
float64
sigdiffrpressure
float64
thermalhist
string
pressurehist
string
compoundsource
string
nel
string
sg
string
sgHall
string
sgNumber
int64
commonname
string
chemname
string
mineral
string
formula
string
calcformula
string
cellformula
string
Z
int64
Zprime
float64
acce_code
string
authors
string
title
string
journal
string
year
int64
volume
int64
issue
string
firstpage
string
lastpage
string
doi
string
method
string
radiation
string
wavelength
float64
radType
string
radSymbol
string
Rall
float64
Robs
float64
Rref
float64
wRall
float64
wRobs
float64
wRref
float64
RFsqd
float64
RI
float64
gofall
float64
gofobs
float64
gofgt
float64
gofref
float64
duplicateof
int64
optimal
int64
status
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flags
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text
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svnrevision
int64
date
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time
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string
1,100,131
8.1138
0.0005
11.471
0.001
12.8233
0.0009
90
null
91.91
0.04
90
null
1,192.85
null
null
null
null
null
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
Sodium Rubidium Tetrahydroxopentaoxotetraborate Tetrahydrate
- B4 H12 Na O13 Rb -
- B4 H12 Na O13 Rb -
- B16 H48 Na4 O52 Rb4 -
4
1
Ben Ali, A.; Smiri, L.; Maisonneuve, V.
Crystal structure of Na Rb B4 O5 (O H)4 * 4(H2 O): comparison with other tetraborate hydrates
Journal of Alloys and Compounds
2,001
322
1-2
153
159
10.1016/S0925-8388(01)01259-2
null
0.045
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ben Ali, A.; Smiri, L.; Maisonneuve, V. Crystal structure of Na Rb B4 O5 (O H)4 * 4(H2 O): comparison with other tetraborate hydrates Journal of Alloys and Compounds 322(1-2) (2001) 153-159
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100131.cif $ #-------------------------------------------------------------------...
1,100,132
3.015
null
3.015
null
3.015
null
90
null
90
null
90
null
27.41
null
null
null
null
null
null
null
null
null
2
Pm-3m
null
austenite
- Ni Ti -
- Ni Ti -
- Ni Ti -
1
null
null
null
null
0
null
null
0
null
null
null
null
0
null
null
null
null
null
has coordinates
()
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100132.cif $ #-------------------------------------------------------------------...
1,100,133
7.119
0.008
11.532
0.006
12.49
0.007
107.14
0.05
95.43
0.07
92.03
0.06
973.3
1.3
280
2
280
2
null
null
null
null
5
P -1
-P 1
2
Bis(p-toluidinium) tetrachlorozincate(II)
Bis(p-toluidinium) tetrachlorozincate(II)
- C14 H20 Cl4 N2 Zn -
- C14 H20 Cl4 N2 Zn -
- C28 H40 Cl8 N4 Zn2 -
2
1
Rademeyer, M.
Bis(p-toluidinium) tetrachlorozincate(II)
Acta Crystallographica Section E
2,005
61
m304
m306
10.1107/S1600536805000747
0.71073
MoKα
0.0789
0.0436
null
null
0.094
0.106
null
null
null
null
null
0.895
null
null
has coordinates
Rademeyer, M. Bis(p-toluidinium) tetrachlorozincate(II) Acta Crystallographica Section E 61 (2005) m304-m306
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/1/10/01/1100133.cif $ #-------------------------------------------------------------------...
1,100,134
16.514
0.0016
11.1559
0.0011
11.2834
0.0011
90
null
115.974
0.002
90
null
1,868.8
0.3
293
2
293
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
catena-(μu-4,4'-Bipyridyl)-bis(2-methyllactate-O,O')-copper(II)
- C18 H22 Cu N2 O6 -
- C18 H22 Cu N2 O6 -
- C72 H88 Cu4 N8 O24 -
4
0.5
Carballo, Rosa; Vázquez-López, Ezequiel M.; Covelo, Berta; Castiñeiras, Alfonso
Coordination polymers of Copper(II) based on mixed N- and O-donor ligands: The crystal structures of [CuL~2~(4,4'-bipy)]~n~ (L = lactate or 2-methyllactate)'
Polyhedron
2,001
20
9-10
899
904
10.1016/S0277-5387(01)00749-5
0.71073
MoKα
0.0757
0.0497
null
null
0.1114
0.1203
null
null
null
null
null
0.967
null
null
has coordinates
Carballo, Rosa; Vázquez-López, Ezequiel M.; Covelo, Berta; Castiñeiras, Alfonso Coordination polymers of Copper(II) based on mixed N- and O-donor ligands: The crystal structures of [CuL~2~(4,4'-bipy)]~n~ (L = lactate or 2-methyllactate)' Polyhedron 20(9-10) (2001) 899-904
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/1/10/01/1100134.cif $ #-------------------------------------------------------------------...
1,100,135
14.443
0.002
11.2031
0.0016
5.3902
0.0008
90
null
104.854
0.002
90
null
843
0.2
293
2
293
2
null
null
null
null
5
C 1 2/m 1
-C 2y
12
catena-(μu-4,4'-Bipyridyl)-bis(lactate-O,O')-copper(II)
- C16 H18 Cu N2 O6 -
- C16 H18 Cu N2 O6 -
- C32 H36 Cu2 N4 O12 -
2
0.25
Carballo, Rosa; Vázquez-López, Ezequiel M.; Covelo, Berta; Castiñeiras, Alfonso
Coordination polymers of Copper(II) based on mixed N- and O-donor ligands: The crystal structures of [CuL~2~(4,4'-bipy)]~n~ (L = lactate or 2-methyllactate)'
Polyhedron
2,001
20
9-10
899
904
10.1016/S0277-5387(01)00749-5
0.71073
MoKα
0.0366
0.0345
null
null
0.0877
0.0885
null
null
null
null
null
1.118
null
null
has coordinates
Carballo, Rosa; Vázquez-López, Ezequiel M.; Covelo, Berta; Castiñeiras, Alfonso Coordination polymers of Copper(II) based on mixed N- and O-donor ligands: The crystal structures of [CuL~2~(4,4'-bipy)]~n~ (L = lactate or 2-methyllactate)' Polyhedron 20(9-10) (2001) 899-904
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/1/10/01/1100135.cif $ #-------------------------------------------------------------------...
1,100,136
4.0855
0.0001
4.0855
0.0001
4.0855
0.0001
90
null
90
null
90
null
68.2
null
null
null
null
null
null
null
null
null
1
F m -3 m
-F 4 2 3
225
Silver - 3C
Silver
- Ag -
- Ag -
- Ag4 -
4
0.020833
Spreadborough, J; Christian, J W
High-temperature X-ray diffractometer
Journal of Scientific Instruments
1,959
36
116
118
10.1088/0950-7671/36/3/302
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Spreadborough, J; Christian, J W High-temperature X-ray diffractometer Journal of Scientific Instruments 36 (1959) 116-118
202,026
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-16 01:16:12 +0300 (Mon, 16 Oct 2017) $ #$Revision: 202026 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100136.cif $ #-------------------------------------------------------------------...
1,100,137
10.5297
0.0006
12.6897
0.0008
6.9432
0.0004
90
null
94.782
0.001
90
null
924.51
0.09
298
2
298
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
Di(nitrate)bis(mu-7,8-dihydro-7-oxo-1,2,4-triazolo[4,3-a]pyrimidine-N1,N2) disilver(I) dihydrate
- C10 H12 Ag2 N10 O10 -
- C10 H12 Ag2 N10 O10 -
- C20 H24 Ag4 N20 O20 -
2
0.5
Sawsan Salameh; Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Inorganica Chimica Acta
2,005
358
824
827
10.1016/j.ica.2004.09.025
0.71073
MoKα
0.0256
0.0232
null
null
0.0582
0.0592
null
null
null
null
null
1.067
null
null
has coordinates
Sawsan Salameh; Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Inorganica Chimica Acta 358 (2005) 824-827
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/1/10/01/1100137.cif $ #-------------------------------------------------------------------...
1,100,138
4.07
0.01
4.07
0.01
4.07
0.01
90
null
90
null
90
null
67.42
null
null
null
null
null
null
null
null
null
1
F m -3 m
-F 4 2 3
225
Gold - 3C
Gold
- Au -
- Au -
- Au4 -
4
0.020833
J. Spreadborough; J. W. Christian
High-temperature X-ray diffractometer
Journal of Scientific Instruments
1,959
36
116
118
10.1088/0950-7671/36/3/302
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
J. Spreadborough; J. W. Christian High-temperature X-ray diffractometer Journal of Scientific Instruments 36 (1959) 116-118
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100138.cif $ #-------------------------------------------------------------------...
1,100,139
11.3215
0.001
11.908
0.002
16.4596
0.0014
71.538
0.017
71.675
0.007
78.681
0.013
1,986.6
0.5
295
1
295
1
null
null
null
null
6
P -1
-P 1
2
- C27 H37 Au Br4 N12 O9 -
- C27 H30 Au Br4 N12 O9 -
- C54 H60 Au2 Br8 N24 O18 -
2
1
Esther R. Acuna-Cueva; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros
Structural Chemistry
2,004
15
159
163
10.1023/B:STUC.0000011250.33484.84
0.71073
MoKα
0.1194
0.089
null
null
0.2346
0.2771
null
null
null
null
null
1.017
null
null
has coordinates
Esther R. Acuna-Cueva; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Structural Chemistry 15 (2004) 159-163
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/1/10/01/1100139.cif $ #-------------------------------------------------------------------...
1,100,140
17.076
0.003
19.341
0.003
13.481
0.002
90
null
90
null
90
null
4,452.3
1.2
100
2
100
2
null
null
null
null
6
P n n 2
P 2 -2n
34
(Cu3Cl2(OH)3(2-pymo)(4,4'-bpy)1.5)n(NO3)n.6.25nH2O
- C34 H41.5 Cl2 Cu3 N9 O12.25 -
- C34 H27 Cl2 Cu3 N9 O12.25 -
- C136 H108 Cl8 Cu12 N36 O49 -
4
1
Barea, Elisa; Quiros, Miguel; Navarro, Jorge A. R.; Salas, Juan M.
Heteroleptic pyrimidine-2-olate and 4,4[prime or minute]-bipyridine copper(II) layered metal-organic frameworks with swelling properties.
Dalton transactions (Cambridge, England : 2003)
2,005
null
9
1743
1746
10.1039/b500942a
0.71073
MoKα
0.1154
0.0841
null
null
0.201
0.2176
null
null
null
null
null
1.099
null
null
has coordinates
Barea, Elisa; Quiros, Miguel; Navarro, Jorge A. R.; Salas, Juan M. Heteroleptic pyrimidine-2-olate and 4,4[prime or minute]-bipyridine copper(II) layered metal-organic frameworks with swelling properties. Dalton transactions (Cambridge, England : 2003) (issue 9) (2005) 1743-1746
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100140.cif $ #-------------------------------------------------------------------...
1,100,141
7.4026
0.0011
15.023
0.002
12.308
0.0018
90
null
90
null
90
null
1,368.8
0.3
153
2
153
2
null
null
null
null
3
P n a 21
P 2c -2n
33
- C18 H16 O3 -
- C18 H16 O3 -
- C72 H64 O12 -
4
1
null
null
0.71073
MoKα
0.1067
0.0545
null
null
0.0887
0.106
null
null
null
null
null
0.983
null
null
has coordinates
()
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/1/10/01/1100141.cif $ #-------------------------------------------------------------------...
1,100,142
10.0218
0.0009
9.3216
0.0008
16.2203
0.0013
90
null
112.962
0.006
90
null
1,395.2
0.2
293
2
293
2
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
- Cl Co Cr2 H20 N6 O8 -
- Cl Co Cr2 H20 N6 O8 -
- Cl4 Co4 Cr8 H80 N24 O32 -
4
1
Raj Pal Sharma; Ritu Bala; Rajni Sharma; Juan M. Salas; Miguel Quiros
Journal of Coordination Chemistry
2,005
58
217
223
10.1080/0095897042000327888
0.71073
MoKα
0.0373
0.0326
null
0.0949
0.0906
null
null
null
1.072
1.091
1.091
null
null
null
has coordinates
Raj Pal Sharma; Ritu Bala; Rajni Sharma; Juan M. Salas; Miguel Quiros Journal of Coordination Chemistry 58 (2005) 217-223
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100142.cif $ #-------------------------------------------------------------------...
1,100,143
12.195
0.0006
9.0317
0.0005
12.6017
0.0007
90
null
113.419
0.001
90
null
1,273.63
0.12
295
2
295
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C5 H16 Co N11 S -
- C5 H16 Co N11 S -
- C20 H64 Co4 N44 S4 -
4
1
Raj Pal Sharma; Rajni Sharma; Ritu Bala; Miguel Quiros; Juan M. Salas
Journal of Coordination Chemistry
2,003
56
1581
1586
10.1080/00958970310001641673
0.71073
MoKα
0.0297
0.0262
null
null
0.0678
0.0697
null
null
null
null
null
1.039
null
null
has coordinates
Raj Pal Sharma; Rajni Sharma; Ritu Bala; Miguel Quiros; Juan M. Salas Journal of Coordination Chemistry 56 (2003) 1581-1586
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/1/10/01/1100143.cif $ #-------------------------------------------------------------------...
1,100,144
13.2319
0.0009
8.1677
0.0007
12.9061
0.0009
90
null
109.305
0.005
90
null
1,316.39
0.17
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C18 H24 Co N10 O12 -
- C18 H24 Co N10 O12 -
- C36 H48 Co2 N20 O24 -
2
0.5
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros
Inorganica Chimica Acta
2,003
342
209
218
10.1016/S0020-1693(02)01165-9
0.71073
MoKα
0.1266
0.0571
null
null
0.1248
0.154
null
null
null
null
null
0.991
null
null
has coordinates
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta 342 (2003) 209-218
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/1/10/01/1100144.cif $ #-------------------------------------------------------------------...
1,100,145
15.1701
0.001
8.0805
0.0006
17.7233
0.0017
90
null
103.022
0.006
90
null
2,116.7
0.3
293
2
293
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
- C14 H16 Cu N10 O12 -
- C14 H16 Cu N10 O12 -
- C56 H64 Cu4 N40 O48 -
4
0.5
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros
Inorganica Chimica Acta
2,003
342
209
218
10.1016/S0020-1693(02)01165-9
0.71073
MoKα
0.0446
0.0359
null
null
0.0959
0.1014
null
null
null
null
null
1.073
null
null
has coordinates
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta 342 (2003) 209-218
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/1/10/01/1100145.cif $ #-------------------------------------------------------------------...
1,100,146
8.8152
0.001
10.0526
0.0012
15.344
0.002
90
null
91.521
0.009
90
null
1,359.3
0.3
293
2
293
2
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
- C9 H12 Cl2 Cu N4 O3 -
- C9 H12 Cl2 Cu N4 O3 -
- C36 H48 Cl8 Cu4 N16 O12 -
4
1
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros
Inorganica Chimica Acta
2,003
351
356
362
10.1016/S0020-1693(03)00172-5
0.71073
MoKα
0.0504
0.0411
null
null
0.1111
0.1178
null
null
null
null
null
1.072
null
null
has coordinates
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta 351 (2003) 356-362
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/1/10/01/1100146.cif $ #-------------------------------------------------------------------...
1,100,147
9.2608
0.001
10.3755
0.0011
12.9865
0.0014
85.76
0.002
75.915
0.002
73
0.002
1,157.4
0.2
293
2
293
2
null
null
null
null
6
P -1
-P 1
2
Tetrakis(2,2'-bipyridine-N,N')-dichloro-bis(mu!3$-hydroxo) -bis(mu!2$-hydroxo)-tetracopper(II) dichloride hexahydrate
- C40 H48 Cl4 Cu4 N8 O10 -
- C40 H48 Cl4 Cu4 N8 O10 -
- C40 H48 Cl4 Cu4 N8 O10 -
1
0.5
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia; Covelo, Berta; Castineiras, Alfonso
An X-Ray Study of the Crystal Structure of a new stepped- cubane tetranuclear copper(II) compound, [Cu~4~(μ~2~-OH) ~2~(μ~3~-OH)~2~Cl~2~(bipy)~4~]Cl~2~.6H~2~O
Z. Anorg. Allg. Chem.
2,002
628
907
908
10.1002/1521-3749(200206)628:5<907::AID-ZAAC907>3.0.CO;2-K
0.71073
MoKα
0.1255
0.0529
null
null
0.0908
0.1055
null
null
null
null
null
0.832
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia; Covelo, Berta; Castineiras, Alfonso An X-Ray Study of the Crystal Structure of a new stepped- cubane tetranuclear copper(II) compound, [Cu~4~(μ~2~-OH) ~2~(μ~3~-OH)~2~Cl~2~(bipy)~4~]Cl~2~.6H~2~O Z. Anorg. Allg. Chem. 628 (2002) 907-908
198,667
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-07-12 10:07:33 +0300 (Wed, 12 Jul 2017) $ #$Revision: 198667 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100147.cif $ #-------------------------------------------------------------------...
1,100,148
14.4717
0.0005
6.4247
0.0002
18.4846
0.0006
90
null
90
null
90
null
1,718.63
0.1
293
2
295
2
null
null
null
null
5
P b c a
-P 2ac 2ab
61
- C10 H12 Cu N10 O10 -
- C10 H12 Cu N10 O10 -
- C40 H48 Cu4 N40 O40 -
4
0.5
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Diaquabis(nitrato-O)bis(4,7-dihydro-1,2,4-triazolo [1,5-a]pyrimidine-7-one-N^3^)copper(II).
Acta Crystallographica Section E
2,003
59
m903
m905
10.1107/S1600536803019974
0.71073
MoKα
0.0802
0.057
null
null
0.1398
0.1658
null
null
null
1.113
1.113
1.082
2,202,376
null
has coordinates
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Diaquabis(nitrato-O)bis(4,7-dihydro-1,2,4-triazolo [1,5-a]pyrimidine-7-one-N^3^)copper(II). Acta Crystallographica Section E 59 (2003) m903-m905
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/1/10/01/1100148.cif $ #-------------------------------------------------------------------...
1,100,149
9.556
0.0017
13.408
0.003
14.48
0.003
108.097
0.004
94.267
0.005
110.194
0.004
1,620.4
0.6
293
2
293
2
null
null
null
null
5
P -1
-P 1
2
Diaqua-bis(1,10-phenanthroline-N,N')cobalt(II) acetate hexahydrate
- C28 H38 Co N4 O12 -
- C28 H38 Co N4 O12 -
- C56 H76 Co2 N8 O24 -
2
1
Carballo, Rosa; Covelo, Berta; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia
Unexpected formation and crystal structures of the mixed ligand complexes [Cu(OAc)(bipy)2]Cl.4H2O.1/2MeOH and [Co(OH2)2(phen)2](AcO)2. 6H2O
Z. Anorg. Allg. Chem.
2,003
629
244
248
10.1002/zaac.200390039
0.71073
MoKα
0.1578
0.0503
null
null
0.0736
0.0923
null
null
null
null
null
0.724
null
null
has coordinates
Carballo, Rosa; Covelo, Berta; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia Unexpected formation and crystal structures of the mixed ligand complexes [Cu(OAc)(bipy)2]Cl.4H2O.1/2MeOH and [Co(OH2)2(phen)2](AcO)2. 6H2O Z. Anorg. Allg. Chem. 629 (2003) 244-248
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100149.cif $ #-------------------------------------------------------------------...
1,100,150
8.8328
0.0008
10.5365
0.001
14.4604
0.0014
96.512
0.002
104.786
0.002
92.26
0.002
1,289.5
0.2
293
2
293
2
null
null
null
null
6
P -1
-P 1
2
(Acetato-O)-bis(2,2'-bipyridine-N,N')copper(II) chloride tetrahydrate methanol hemisolvate
- C22.5 H29 Cl Cu N4 O6.5 -
- C22.5 H19.5 Cl Cu N4 O6.5 -
- C45 H39 Cl2 Cu2 N8 O13 -
2
1
Carballo, Rosa; Covelo, Berta; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia
Unexpected formation and crystal structures of the mixed ligand complexes [Cu(OAc)(bipy)2]Cl.4H2O.1/2MeOH and [Co(OH2)2(phen)2](AcO)2. 6H2O
Z. Anorg. Allg. Chem.
2,003
629
244
248
10.1002/zaac.200390039
0.71073
MoKα
0.0812
0.0611
null
null
0.1712
0.1822
null
null
null
null
null
1.016
null
null
has coordinates
Carballo, Rosa; Covelo, Berta; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia Unexpected formation and crystal structures of the mixed ligand complexes [Cu(OAc)(bipy)2]Cl.4H2O.1/2MeOH and [Co(OH2)2(phen)2](AcO)2. 6H2O Z. Anorg. Allg. Chem. 629 (2003) 244-248
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100150.cif $ #-------------------------------------------------------------------...
1,100,151
29.437
0.004
10.2477
0.0014
24.223
0.003
90
null
111.758
0.003
90
null
6,786.5
1.6
293
2
293
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Bis(2-methyllactato-O,O')(1,10-phenanthroline-N,N') copper(II) dihydrate
- C20 H26 Cu N2 O8 -
- C20 H26 Cu N2 O8 -
- C240 H312 Cu12 N24 O96 -
12
1.5
Carballo, Rosa; Covelo, Berta; VVázquez-López, Ezequiel M.; Castiñeiras, Alfonso; Niclos, Juan
Synthesis and structural characterization of the mixed ligand complex [Cu(HmL)2(phen)].2H2O (H2mL = 2-methyllactic acid)
Zeitschrift für Naturforschung B
2,003
58
1
151
154
10.1515/znb-2003-0122
0.71073
MoKα
0.1546
0.0464
null
null
0.0763
0.0933
null
null
null
null
null
0.756
null
null
has coordinates
Carballo, Rosa; Covelo, Berta; VVázquez-López, Ezequiel M.; Castiñeiras, Alfonso; Niclos, Juan Synthesis and structural characterization of the mixed ligand complex [Cu(HmL)2(phen)].2H2O (H2mL = 2-methyllactic acid) Zeitschrift für Naturforschung B 58(1) (2003) 151-154
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100151.cif $ #-------------------------------------------------------------------...
1,100,152
19.666
0.002
11.7586
0.0008
13.4808
0.0009
90
null
103.69
0.008
90
null
3,028.8
0.5
295
1
293
2
null
null
null
null
6
C 1 2/c 1
-C 2yc
15
bis(2,2'-biimidazole)copper(II) perchlorate bis(4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-7-one
- C22 H20 Cl2 Cu N16 O10 -
- C22 H20 Cl2 Cu N16 O10 -
- C88 H80 Cl8 Cu4 N64 O40 -
4
0.5
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Structure of the adduct of bis(2,2'biimidazole)copper(II) perchlorate with 4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-7-one
Journal of Chemical Crystallography
2,004
34
8
549
552
10.1023/B:JOCC.0000042024.70444.a0
0.71073
MoKα
0.1388
0.0806
null
null
0.1905
0.2456
null
null
null
null
null
1.025
null
null
has coordinates,has disorder
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Structure of the adduct of bis(2,2'biimidazole)copper(II) perchlorate with 4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-7-one Journal of Chemical Crystallography 34(8) (2004) 549-552
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100152.cif $ #-------------------------------------------------------------------...
1,100,153
7.5397
0.0016
10.5338
0.0019
10.907
0.002
90
null
109.557
0.017
90
null
816.3
0.3
300
2
300
2
null
null
null
null
4
P 1 21/c 1
-P 2ybc
14
- Ca4 F2 O7 Si2 -
- Ca4 F2 O7 Si2 -
- Ca16 F8 O28 Si8 -
4
1
Kruger, Hannes; Kahlenberg, Volker
null
null
0.71073
MoKα
0.0538
0.0341
null
null
0.0614
0.0664
null
null
null
null
null
1.045
null
null
has coordinates
Kruger, Hannes; Kahlenberg, Volker ()
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/1/10/01/1100153.cif $ #-------------------------------------------------------------------...
1,100,154
6.1505
0.0006
7.6367
0.0008
9.7197
0.001
95.0132
0.0015
99.9045
0.0015
110.281
0.0014
416.47
0.07
100
2
100
2
null
null
null
null
6
P -1
-P 1
2
trans-Dichloro bis(3-amino-1,2,4-triazolium-N^1^) copper(II) tetrachlorocuprate(II) dihydrate.
- C4 H14 Cl6 Cu2 N8 O2 -
- C4 H14 Cl6 Cu2 N8 O2 -
- C4 H14 Cl6 Cu2 N8 O2 -
1
0.5
Carlos Sanchez; Juan M. Salas; Miguel Quiros; M. Purificacion Sanchez
trans-Dichloro bis(3-amino-1,2,4-triazolium-N^1^) copper(II) tetrachlorocuprate(II) dihydrate.
Acta Crystallographica Section E
2,004
60
m370
m372
10.1107/S1600536804003812
0.71073
MoKα
0.0184
0.0177
null
null
0.0457
0.0461
null
null
null
null
null
1.083
2,203,434
null
has coordinates
Carlos Sanchez; Juan M. Salas; Miguel Quiros; M. Purificacion Sanchez trans-Dichloro bis(3-amino-1,2,4-triazolium-N^1^) copper(II) tetrachlorocuprate(II) dihydrate. Acta Crystallographica Section E 60 (2004) m370-m372
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/1/10/01/1100154.cif $ #-------------------------------------------------------------------...
1,100,155
12.78
0.02
17.04
0.03
19.13
0.05
90
null
104.82
0.02
90
null
4,027.5
1.4
173.1
null
null
null
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
- C35 H46 Cl2 I N3 Ni O2 -
- C24.6667 Cl2.66667 I0.666667 N2 Ni0.666667 -
- C148 Cl16 I4 N12 Ni4 -
6
1.5
null
null
0.7107
MoKα
null
0.126
null
null
null
0.374
null
null
null
null
null
1.346
null
null
has coordinates
()
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/1/10/01/1100155.cif $ #-------------------------------------------------------------------...
1,100,156
9.17
0.003
10.936
0.003
12.717
0.004
106.91
0.007
110.208
0.006
90.172
0.007
1,137.4
0.6
293
2
293
2
null
null
null
null
5
P -1
-P 1
2
- C22 H22 N4 Ni O6 -
- C22 H22 N4 Ni O6 -
- C44 H44 N8 Ni2 O12 -
2
1
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.1784
0.0541
null
null
0.0629
0.0816
null
null
null
null
null
0.644
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100156.cif $ #-------------------------------------------------------------------...
1,100,157
9.2191
0.0011
29.972
0.004
12.5644
0.0015
90
null
94.428
0.003
90
null
3,461.3
0.7
293
2
293
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C37 H34 N6 Ni O6 -
- C37 H34 N6 Ni O6 -
- C148 H136 N24 Ni4 O24 -
4
1
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.2271
0.1056
null
null
0.1633
0.2022
null
null
null
null
null
1.072
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100157.cif $ #-------------------------------------------------------------------...
1,100,158
5.528
0.002
7.267
0.003
13.626
0.005
75.045
0.005
85.826
0.006
75.613
0.007
512.2
0.3
293
2
293
2
null
null
null
null
5
P -1
-P 1
2
- C7 H10 Cu N2 O6 -
- C7 H10 Cu N2 O6 -
- C14 H20 Cu2 N4 O12 -
2
1
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.0965
0.0675
null
null
0.1157
0.1259
null
null
null
null
null
1.092
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100158.cif $ #-------------------------------------------------------------------...
1,100,159
5.422
0.003
13.436
0.007
17
0.009
90
null
92.324
0.011
90
null
1,237.4
1.1
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C9 H14 Cu N2 O6 -
- C9 H14 Cu N2 O6 -
- C36 H56 Cu4 N8 O24 -
4
1
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.2235
0.0495
null
null
0.0686
0.0926
null
null
null
null
null
0.753
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100159.cif $ #-------------------------------------------------------------------...
1,100,160
9.6623
0.0015
17.63
0.003
9.7978
0.0016
90
null
118.748
0.003
90
null
1,463.3
0.4
293
2
293
2
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
- C11 H18 Cu N2 O6 -
- C11 H18 Cu N2 O6 -
- C44 H72 Cu4 N8 O24 -
4
1
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.1503
0.0448
null
null
0.0511
0.0634
null
null
null
null
null
0.694
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100160.cif $ #-------------------------------------------------------------------...
1,100,161
20.4557
0.0018
10.4408
0.0009
15.0918
0.0013
90
null
90
null
90
null
3,223.2
0.5
293
2
293
2
null
null
null
null
5
P b c n
-P 2n 2ab
60
- C12 H19 N4 O6.5 Zn -
- C12 H18 N4 O6.5 Zn -
- C96 H144 N32 O52 Zn8 -
8
1
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.1021
0.0401
null
null
0.0869
0.0986
null
null
null
null
null
0.924
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100161.cif $ #-------------------------------------------------------------------...
1,100,162
10.7634
0.0009
10.7634
0.0009
16.442
0.003
90
null
90
null
90
null
1,904.8
0.4
293
2
293
2
null
null
null
null
5
P 43 21 2
P 4nw 2abw
96
- C14 H22 N4 O6 Zn -
- C14 H22 N4 O6 Zn -
- C56 H88 N16 O24 Zn4 -
4
0.5
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.0369
0.0326
null
null
0.0809
0.0828
null
null
null
null
null
1.157
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100162.cif $ #-------------------------------------------------------------------...
1,100,163
12.9507
0.0017
9.0191
0.0011
22.209
0.003
90
null
119.763
0.006
90
null
2,251.9
0.5
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
- C46 H46 N12 O6 Zn -
- C46 H46 N12 O6 Zn -
- C92 H92 N24 O12 Zn2 -
2
0.5
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.1162
0.0621
null
null
0.1005
0.1152
null
null
null
null
null
1.048
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100163.cif $ #-------------------------------------------------------------------...
1,100,164
19.392
0.007
8.477
0.003
11.412
0.004
90
null
111.795
0.007
90
null
1,741.9
1.1
293
2
293
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
- C14 H22 N4 Ni O6 -
- C14 H22 N4 Ni O6 -
- C56 H88 N16 Ni4 O24 -
4
0.5
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan
'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole'
Polyhedron
2,004
23
1505
1518
10.1016/j.poly.2004.02.028
0.71073
MoKα
0.0409
0.0317
null
null
0.0663
0.0691
null
null
null
null
null
1.059
null
null
has coordinates
Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100164.cif $ #-------------------------------------------------------------------...
1,100,165
7.543
0.0008
13.1384
0.0012
17.2599
0.001
90
null
90
null
90
null
1,710.5
0.3
293
2
293
2
null
null
null
null
5
P b c a
-P 2ac 2ab
61
Diaqua bis(4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-7-one-N3)zinc(II) tetrah
- C10 H18 N8 O8 Zn -
- C10 H18 N8 O8 Zn -
- C40 H72 N32 O32 Zn4 -
4
0.5
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Polyhedron
2,004
23
743
747
10.1016/j.poly.2003.11.052
0.71073
MoKα
0.1402
0.0872
null
null
0.2186
0.276
null
null
null
null
null
1.025
null
null
has coordinates
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron 23 (2004) 743-747
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/1/10/01/1100165.cif $ #-------------------------------------------------------------------...
1,100,166
17.417
0.003
21.402
0.004
11.298
0.002
90
null
117.15
0.03
90
null
3,747.4
1.2
546
2
546
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
- C44.75 H32 Ag O2 P2 -
- C44.82 H32 Ag O2 P2 -
- C179.28 H128 Ag4 O8 P8 -
4
0.5
Norie Momiyama; Hisashi Yamamoto
Enantioselective O- and N-Nitroso Aldol Synthesis of Tin Enolates. Isolation of Three BINAP-Silver Complexes and Their Role in Regio- and Enantioselectivity
Journal of the American Chemical Society
2,004
126
5360
5361
10.1021/ja039103i
0.71073
MoKα
0.0963
0.094
null
null
0.3306
0.3336
null
null
null
null
null
1.587
null
null
has coordinates
Norie Momiyama; Hisashi Yamamoto Enantioselective O- and N-Nitroso Aldol Synthesis of Tin Enolates. Isolation of Three BINAP-Silver Complexes and Their Role in Regio- and Enantioselectivity Journal of the American Chemical Society 126 (2004) 5360-5361
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/1/10/01/1100166.cif $ #-------------------------------------------------------------------...
1,100,167
5.53649
0.00005
5.74713
0.00005
7.69259
0.00007
90
null
90
null
90
null
244.77
0.004
null
null
null
null
null
null
null
null
3
P b n m
-P 2c 2ab
62
- La Mn O3 -
- La4 Mn4 O12 -
- La4 Mn4 O12 -
null
null
null
null
powder diffraction
neutron
1.2272
ConstantWavelengthNeutronDiffraction
null
null
null
null
null
null
null
4.9552
null
null
null
null
null
null
has coordinates
()
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/1/10/01/1100167.cif $ #-------------------------------------------------------------------...
1,100,168
6.5185
0.0009
7.5119
0.0011
10.7736
0.0009
94.351
0.01
106.036
0.008
109.334
0.014
470.21
0.1
293
2
293
2
null
null
null
null
6
P -1
-P 1
2
- C14 H12 Br2 N8 O4 Pd -
- C14 H12 Br2 N8 O4 Pd -
- C14 H12 Br2 N8 O4 Pd -
1
0.5
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros
Polyhedron
2,003
22
483
488
10.1016/S0277-5387(02)01374-8
0.71073
MoKα
0.0953
0.072
null
null
0.1998
0.2209
null
null
null
null
null
1.074
null
null
has coordinates
Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Polyhedron 22 (2003) 483-488
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/1/10/01/1100168.cif $ #-------------------------------------------------------------------...
1,100,169
12.864
0.002
14.634
0.002
30.703
0.003
90
null
90
null
90
null
5,779.7
1.4
293
2
293
2
null
null
null
null
5
C 2 2 21
C 2c 2
20
Tetrakis(4,5-dihydro-1,2,4-triazolo[1,5-a]pyrimidinate-5-one-mu-N3,N4) dipalladium(II) tetrahydrate
- C20 H20 N16 O8 Pd2 -
- C20 H12 N16 O8 Pd2 -
- C160 H96 N128 O64 Pd16 -
8
1
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Polyhedron
2,004
23
2373
2379
10.1016/j.poly.2004.07.024
0.71073
MoKα
0.0857
0.0765
null
null
0.1864
0.1972
null
null
null
null
null
1.256
null
null
has coordinates
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron 23 (2004) 2373-2379
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/1/10/01/1100169.cif $ #-------------------------------------------------------------------...
1,100,170
19.688
0.012
14.219
0.012
14.448
0.006
90
null
110.02
0.04
90
null
3,800
4
293
2
293
2
null
null
null
null
5
C 1 2/c 1
-C 2yc
15
Bis(4,5-dihydro-1,2,4-triazolo[1,5-a]pyrimidinate-5-one-mu-N3-N4) bis(phenanthroline)dipalladium(II) nitrate tetrahydrate
- C34 H30 N14 O12 Pd2 -
- C34 H22 N14 O12 Pd2 -
- C136 H88 N56 O48 Pd8 -
4
0.5
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Polyhedron
2,004
23
2373
2379
10.1016/j.poly.2004.07.024
0.71073
MoKα
0.1484
0.0793
null
null
0.192
0.2325
null
null
null
null
null
1.049
null
null
has coordinates
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron 23 (2004) 2373-2379
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/1/10/01/1100170.cif $ #-------------------------------------------------------------------...
1,100,171
10.2842
0.0015
18.92
0.003
18.45
0.003
90
null
104.117
0.01
90
null
3,481.5
0.9
293
2
293
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
Bis(4,5-dihydro-1,2,4-triazolo[1,5-a]pyrimidinate-5-one-mu-N3,N4) bis(trans-diaminociclohexane) dipalladium(II) nitrate tetrahydrate
- C22 H40 N14 O11 Pd2 -
- C22 H34 N14 O11 Pd2 -
- C88 H136 N56 O44 Pd8 -
4
1
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas
Polyhedron
2,004
23
2373
2379
10.1016/j.poly.2004.07.024
0.71073
MoKα
0.0604
0.0487
null
null
0.1171
0.1238
null
null
null
null
null
1.136
null
null
has coordinates,has disorder
Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron 23 (2004) 2373-2379
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/1/10/01/1100171.cif $ #-------------------------------------------------------------------...
1,100,172
10.432
0.0003
5.645
0.0002
16.783
0.0002
90
null
94.943
0.003
90
null
984.65
0.05
293
2
293
2
null
null
null
null
4
P 1 21 1
P 2yb
4
D-Phynylglycinium nitrate
D-Phenylglycinium nitrate
- C8 H10 N2 O5 -
- C8 H10 N2 O5 -
- C32 H40 N8 O20 -
4
2
Bouchouit, Karim; Bendheif, Leulmi; Benali-Cherif, Nouredine
D-Phenylglycinium nitrate
Acta Crystallographica, Section E
2,004
60
o272
o274
10.1107/S1600536804000972
0.71073
MoKα
0.0858
0.0563
null
null
0.116
0.1381
null
null
null
null
null
1.158
null
null
has coordinates
Bouchouit, Karim; Bendheif, Leulmi; Benali-Cherif, Nouredine D-Phenylglycinium nitrate Acta Crystallographica, Section E 60 (2004) o272-o274
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/1/10/01/1100172.cif $ #-------------------------------------------------------------------...
1,100,173
9.3531
0.0011
10.5002
0.0013
15.9
0.002
90
null
90
null
90
null
1,561.53
null
null
null
null
null
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
- C15 H22 N2 O4 -
- C15 H22 N2 O4 -
- C60 H88 N8 O16 -
4
1
Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus
Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone
European Journal of Organic Chemistry
1,999
1,999
11
2977
2990
10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone European Journal of Organic Chemistry 1999(11) (1999) 2977-2990
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100173.cif $ #-------------------------------------------------------------------...
1,100,174
19.349
0.002
10.7833
0.0007
19.663
0.002
90
null
111.04
0.008
90
null
3,829.09
null
null
null
193
null
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
tetrakis(Triethylphosphoraneimino-N)-nickel(ii) di-iodide
- C24 H64 I2 N4 Ni P4 -
- C27 H74 I2 N4 Ni P4 -
- C108 H296 I8 N16 Ni4 P16 -
4
1
Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt
Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
8
1928
1931
10.1002/1521-3749(200108)627:8<1928::AID-ZAAC1928>3.0.CO;2-V
null
null
4.3
null
null
4.3
null
null
null
null
null
null
null
null
null
has coordinates,has disorder
Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~ Zeitschrift fuer Anorganische und Allgemeine Chemie 627(8) (2001) 1928-1931
183,538
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-06-16 14:46:25 +0300 (Thu, 16 Jun 2016) $ #$Revision: 183538 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100174.cif $ #-------------------------------------------------------------------...
1,100,175
20.0757
0.001
20.642
0.001
21.1595
0.0011
109.193
0.004
111.285
0.004
96.879
0.004
7,425.96
null
null
null
193
null
null
null
null
null
6
P -1
-P 1
2
tetrakis(Triphenylphosphoraneiminato)-hafnium tetrahydrofuran solvate
- C84 H84 Hf N4 O3 P4 -
- C84 H84 Hf N4 O3 P4 -
- C336 H336 Hf4 N16 O12 P16 -
4
2
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt
Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
8
1801
1806
10.1002/1521-3749(200108)627:8<1801::AID-ZAAC1801>3.0.CO;2-9
null
null
5.06
null
null
5.06
null
null
null
null
null
null
null
null
null
has coordinates
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 627(8) (2001) 1801-1806
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100175.cif $ #-------------------------------------------------------------------...
1,100,176
14.4397
0.001
19.2812
0.0014
24.5579
0.0017
67.273
0.008
87.445
0.008
87.082
0.008
6,295.93
null
null
null
193
null
null
null
null
null
6
P -1
-P 1
2
trans-Dichloro-bis(triphenylphosphoraneimine)-bis(triphenylphosphoraneiminato)-hafnium
- C72 H62 Cl2 Hf N4 P4 -
- C72 H62 Cl2 Hf N4 P4 -
- C288 H248 Cl8 Hf4 N16 P16 -
4
2
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt
Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
8
1801
1806
10.1002/1521-3749(200108)627:8<1801::AID-ZAAC1801>3.0.CO;2-9
null
null
3.12
null
null
3.12
null
null
null
null
null
null
null
null
null
has coordinates
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 627(8) (2001) 1801-1806
176,967
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-25 14:16:41 +0200 (Thu, 25 Feb 2016) $ #$Revision: 176967 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100176.cif $ #-------------------------------------------------------------------...
1,100,177
7.685
0.002
5.006
0.001
18.58
0.005
90
null
97.94
0.02
90
null
707.941
null
null
null
213
null
null
null
null
null
5
P 1 21 1
P 2yb
4
(S,R)-1-Chloro-2-phenylethyl p-tolyl sulfoxide
- C15 H15 Cl O S -
- C21 H22 Cl O S -
- C42 H44 Cl2 O2 S2 -
2
1
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus
Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents
Chemistry - A European Journal
2,000
6
18
3359
3365
10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U
null
null
7
null
null
7
null
null
null
null
null
null
null
null
null
has coordinates
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal 6(18) (2000) 3359-3365
177,552
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 15:42:05 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177552 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100177.cif $ #-------------------------------------------------------------------...
1,100,178
7.842
0.001
12.127
0.001
12.973
0.001
65.76
0.01
86.43
0.01
81.31
0.01
1,112.04
null
null
null
223
null
null
null
null
null
4
P -1
-P 1
2
3-(Diphenylmethyl)pent-2-yl 3,5-dinitrobenzoate
- C25 H24 N2 O6 -
- C25 H24 N2 O6 -
- C50 H48 N4 O12 -
2
1
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul
Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules
Journal of the American Chemical Society
2,000
122
41
10218
10219
10.1021/ja001283y
null
null
4.44
null
null
4.44
null
null
null
null
null
null
null
null
null
has coordinates
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society 122(41) (2000) 10218-10219
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100178.cif $ #-------------------------------------------------------------------...
1,100,179
23.056
0.001
23.056
0.001
7.325
0.001
90
null
90
null
120
null
3,372.15
null
null
null
223
null
null
null
null
null
3
R 3 :H
R 3
146
3,4-Diphenylhexan-2-ol
- C18 H22 O -
- C18 H22 O -
- C162 H198 O9 -
9
1
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul
Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules
Journal of the American Chemical Society
2,000
122
41
10218
10219
10.1021/ja001283y
null
null
3.05
null
null
3.05
null
null
null
null
null
null
null
null
null
has coordinates
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society 122(41) (2000) 10218-10219
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100179.cif $ #-------------------------------------------------------------------...
1,100,180
22.864
0.001
22.864
0.001
7.229
0.001
90
null
90
null
120
null
3,272.75
null
null
null
223
null
null
null
null
null
3
R 3 :H
R 3
146
3,4-Diphenylpentan-2-ol
- C17 H20 O -
- C17 H20 O -
- C153 H180 O9 -
9
1
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul
Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules
Journal of the American Chemical Society
2,000
122
41
10218
10219
10.1021/ja001283y
null
null
4.89
null
null
4.89
null
null
null
null
null
null
null
null
null
has coordinates
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society 122(41) (2000) 10218-10219
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100180.cif $ #-------------------------------------------------------------------...
1,100,181
9.19
0.0008
19.6516
0.0018
24.0125
0.0019
96.748
0.01
94.827
0.01
91.72
0.011
4,287.81
null
null
null
193
null
null
null
null
null
7
P -1
-P 1
2
Amino-triphenylphosphonium tetrakis(isothiocyanato)-bis(1,2-dimethoxyethane-O, O')-samarium(iii) diethyl ether solvate
- C34 H47 N5 O5 P S4 Sm -
- C34 H47 N5 O5 P S4 Sm -
- C136 H188 N20 O20 P4 S16 Sm4 -
4
2
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt
Kristallstruktur des Isothiocyanato-Komplexes [Ph~3~PNH~2~(OEt~2~)][Sm(NCS)~4~(DME)~2~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
2
125
127
10.1002/1521-3749(200102)627:2<125::AID-ZAAC125>3.0.CO;2-O
null
null
2.91
null
null
2.91
null
null
null
null
null
null
null
null
null
has coordinates
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt Kristallstruktur des Isothiocyanato-Komplexes [Ph~3~PNH~2~(OEt~2~)][Sm(NCS)~4~(DME)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 627(2) (2001) 125-127
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100181.cif $ #-------------------------------------------------------------------...
1,100,182
7.8902
0.0002
5.8375
0.0003
20.5524
0.0007
90
null
94.175
0.004
90
null
944.112
null
null
null
213
null
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
threo-4-(Chloro(phenyl)methyl)-1,3-oxazolidin-2-one
- C10 H10 Cl N O2 -
- C10 H10 Cl N O2 -
- C40 H40 Cl4 N4 O8 -
4
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Iron(II)-catalyzed intramolecular aminochlorination of alkenes
Chemical Communications (Cambridge, United Kingdom)
2,000
null
4
287
288
10.1039/a909009f
null
null
4.59
null
null
4.59
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Iron(II)-catalyzed intramolecular aminochlorination of alkenes Chemical Communications (Cambridge, United Kingdom) (issue 4) (2000) 287-288
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100182.cif $ #-------------------------------------------------------------------...
1,100,183
8.52
0.001
12.123
0.001
24.105
0.001
90
null
90
null
90
null
2,489.76
null
null
null
null
null
null
null
null
null
5
P 21 21 21
P 2ac 2ab
19
Menthan-7-yl 2,4,7-trimethyl-2,4-trimethylene-5-pentane lactam-7-carboxylate d ichloromethane solvate
- C23 H39 Cl2 N O3 -
- C23 H39 Cl2 N O3 -
- C92 H156 Cl8 N4 O12 -
4
1
T.Bach; H.Bergmann; K.Harms
Angew.Chem.,Int.Ed.Engl.
2,000
39
2302
10.1002/1521-3773(20000703)39:13<2302::AID-ANIE2302>3.0.CO;2-6
null
null
6.08
null
null
6.08
null
null
null
null
null
null
null
null
null
has coordinates
T.Bach; H.Bergmann; K.Harms Angew.Chem.,Int.Ed.Engl. 39 (2000) 2302
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100183.cif $ #-------------------------------------------------------------------...
1,100,184
8.4889
0.0008
10.5945
0.0008
12.2789
0.0007
90
null
93.793
0.006
90
null
1,101.89
null
null
null
188
null
null
null
null
null
5
P 1 21 1
P 2yb
4
Di-iodo-tris(dimethoxyethane)-europium
- C12 H30 Eu I2 O6 -
- C12 H30 Eu I2 O6 -
- C24 H60 Eu2 I4 O12 -
2
1
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke
Z.Anorg.Allg.Chem.
2,000
626
1361
10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X
null
null
2.46
null
null
2.46
null
null
null
null
null
null
null
null
null
has coordinates
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem. 626 (2000) 1361
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100184.cif $ #-------------------------------------------------------------------...
1,100,185
14.055
0.0014
16.522
0.0015
22.037
0.002
89.404
0.011
72.958
0.011
78.657
0.011
4,791
null
null
null
193
null
null
null
null
null
7
P -1
-P 1
2
bis(μ~2~-Triphenylphosphoraneiminato)-iodo-tris(triphenylphosphoraneiminato)- dimethoxyethane-di-europium dimethoxyethane solvate
- C102 H105 Eu2 I N5 O6 P5 -
- C102 H105 Eu2 I N5 O6 P5 -
- C204 H210 Eu4 I2 N10 O12 P10 -
2
1
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke
Z.Anorg.Allg.Chem.
2,000
626
1361
10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X
null
null
3.91
null
null
3.91
null
null
null
null
null
null
null
null
null
has coordinates
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem. 626 (2000) 1361
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100185.cif $ #-------------------------------------------------------------------...
1,100,186
17.3969
0.0018
17.701
0.002
21.538
0.003
74.929
0.015
84.223
0.014
64.612
0.012
5,785.4
null
null
null
103
null
null
null
null
null
7
P -1
-P 1
2
(μ~2~-Iodo)-bis((μ~2~-triphenylphosphoraneiminato)-triphenylphosphoraneimina to-bis(tetrahydrofuran)-yttrium) tri-iodide tetrahydrofuran solvate
- C114 H144 I4 N4 O10.5 P4 Y2 -
- C116 H152 I11 N4 O12 P4 Y2 -
- C232 H304 I22 N8 O24 P8 Y4 -
2
1
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke
Z.Anorg.Allg.Chem.
2,000
626
1361
10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X
null
null
6.38
null
null
6.38
null
null
null
null
null
null
null
null
null
has coordinates
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem. 626 (2000) 1361
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/1/10/01/1100186.cif $ #-------------------------------------------------------------------...
1,100,187
28.224
0.001
28.224
0.001
15.262
0.001
90
null
90
null
120
null
10,528.8
null
null
null
293
null
null
null
null
null
5
R 3 :H
R 3
146
p-Menth-3-yl 1,3,5-trimethylcyclohexane-1,3-dicarboximide-5-carboxylate dichloromethane solvate
- C22.17 H35.34 Cl0.34 N O4 -
- C22.1667 H35 Cl N O4 -
- C399 H630 Cl18 N18 O72 -
18
2
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt
Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution
Synthesis
2,001
2,001
9
1395
1405
10.1055/s-2001-15231
null
null
5.16
null
null
5.16
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405
178,092
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-10 17:02:39 +0200 (Thu, 10 Mar 2016) $ #$Revision: 178092 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100187.cif $ #-------------------------------------------------------------------...
1,100,188
11.372
0.002
14.9124
0.0013
11.545
0.003
90
null
111.665
0.019
90
null
1,819.54
null
null
null
223
null
null
null
null
null
4
P 1 21/c 1
-P 2ybc
14
rac-1,5,7-Trimethyl-7-(1'-oxa-3'-azacyclopenta(b)naphthalen-2'-yl)-3-azabicyclo(3.3.1)nonan-2-one
- C22 H24 N2 O2 -
- C22 H24 N2 O2 -
- C88 H96 N8 O8 -
4
1
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt
Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution
Synthesis
2,001
2,001
9
1395
1405
10.1055/s-2001-15231
null
null
6.49
null
null
6.49
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/01/1100188.cif $ #-------------------------------------------------------------------...
1,100,189
7.6041
0.0008
15.9342
0.0011
16.4592
0.0011
90
null
90
null
90
null
1,994.28
null
null
null
173
null
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
ent-1,5,7-Trimethyl-7-(5',6',7',8'-tetrahydro-1'-oxa-3'-azacyclopenta(b)naphthalen-2'-yl)-3-azabicyclo(3.3.1)nonan-2-one hydrate
- C22 H28.66 N2 O2.33 -
- C26 H38 N2 O3 -
- C104 H152 N8 O12 -
4
1
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt
Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution
Synthesis
2,001
2,001
9
1395
1405
10.1055/s-2001-15231
null
null
3.05
null
null
3.05
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405
178,092
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-10 17:02:39 +0200 (Thu, 10 Mar 2016) $ #$Revision: 178092 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100189.cif $ #-------------------------------------------------------------------...
1,100,190
7.6183
0.0002
16.092
0.0006
16.4887
0.0006
90
null
90
null
90
null
2,021.41
null
null
null
293
null
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
ent-1,5,7-Trimethyl-7-(5',6',7',8'-tetrahydro-1'-oxa-3'-azacyclopenta(b)naphthalen-2'-yl)-3-azabicyclo(3.3.1)nonan-2-one hydrate
- C22 H28.66 N2 O2.33 -
- C26 H38 N2 O3 -
- C104 H152 N8 O12 -
4
1
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt
Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution
Synthesis
2,001
2,001
9
1395
1405
10.1055/s-2001-15231
null
null
3.06
null
null
3.06
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405
178,092
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-10 17:02:39 +0200 (Thu, 10 Mar 2016) $ #$Revision: 178092 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100190.cif $ #-------------------------------------------------------------------...
1,100,191
14.4126
0.0008
17.328
0.002
18.359
0.001
90
null
101.582
0.007
90
null
4,491.65
null
null
null
193
null
null
null
null
null
3
C 1 2/c 1
-C 2yc
15
octakis(t-Butyl)-hypho-hexagallane(6)
hexakis(μ~2~-Hydrido)-octakis(t-butyl)-hexa-gallium
- C32 H78 Ga6 -
- C76 H192 Ga12 -
- C304 H768 Ga48 -
4
0.5
Uhl, Werner; Cuypers, Lars; Geiseler, Gertraud; Harms, Klaus; Neumüller, Bernhard
Unexpected formation of gallium‒gallium single bonds by irradiation of the hydride [(Me~3~C)~2~GaH]~3~
Journal of the Chemical Society, Dalton Transactions
2,001
null
16
2398
2400
10.1039/b103409j
null
null
5.76
null
null
5.76
null
null
null
null
null
null
null
null
null
has coordinates
Uhl, Werner; Cuypers, Lars; Geiseler, Gertraud; Harms, Klaus; Neumüller, Bernhard Unexpected formation of gallium‒gallium single bonds by irradiation of the hydride [(Me~3~C)~2~GaH]~3~ Journal of the Chemical Society, Dalton Transactions (issue 16) (2001) 2398-2400
177,463
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 12:31:23 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177463 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100191.cif $ #-------------------------------------------------------------------...
1,100,192
10.966
0.001
13.868
0.001
14.306
0.001
79.09
0.01
74.83
0.01
74.74
0.01
2,008.75
null
null
null
193
null
null
null
null
null
6
P -1
-P 1
2
trans-Carbonyl-chloro-bis(2,4,6-triphenylphosphabenzene)-rhodium dichloromethane solvate
- C47.5 H35 Cl2 O P2 Rh -
- C48 H36 Cl3 O P2 Rh -
- C96 H72 Cl6 O2 P4 Rh2 -
2
1
Breit, Bernhard; Winde, Roland; Mackewitz, Thomas; Paciello, Rocco; Harms, Klaus
Phosphabenzenes as Monodentate π-Acceptor Ligands for Rhodium-Catalyzed Hydroformylation
Chemistry - A European Journal
2,001
7
14
3121
10.1002/1521-3765(20010716)7:14<3106::aid-chem3106>3.0.co;2-y
null
null
7.16
null
null
7.16
null
null
null
null
null
null
null
null
null
has coordinates
Breit, Bernhard; Winde, Roland; Mackewitz, Thomas; Paciello, Rocco; Harms, Klaus Phosphabenzenes as Monodentate π-Acceptor Ligands for Rhodium-Catalyzed Hydroformylation Chemistry - A European Journal 7(14) (2001) -3121
177,554
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 15:57:10 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177554 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100192.cif $ #-------------------------------------------------------------------...
1,100,193
6.3611
0.0016
16.313
0.004
8.646
0.0015
90
null
96.089
0.018
90
null
892.122
null
null
null
213
null
null
null
null
null
3
P 1 21/n 1
-P 2yn
14
4,4'-Di-t-butylazobenzene
- C20 H26 N2 -
- C52 H88 N4 -
- C104 H176 N8 -
2
0.5
K.Harms; M.Marsch
Private Communication
2,000
null
null
null
6.55
null
null
6.55
null
null
null
null
null
null
null
null
null
has coordinates
K.Harms; M.Marsch Private Communication (2000)
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/1/10/01/1100193.cif $ #-------------------------------------------------------------------...
1,100,194
8.3847
0.0002
6.8914
0.0004
14.8257
0.0004
90
null
98.28
0.003
90
null
847.734
null
null
null
223
null
null
null
null
null
4
P 1 21/m 1
-P 2yb
11
2-(Adamantyl)-7-nitrofluorene
- C23 H23 N O2 -
- C29 H37 N O2 -
- C58 H74 N2 O4 -
2
0.5
K.Harms; M.Marsch
Private Communication
2,000
null
null
null
5.82
null
null
5.82
null
null
null
null
null
null
null
null
null
has coordinates
K.Harms; M.Marsch Private Communication (2000)
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100194.cif $ #-------------------------------------------------------------------...
1,100,195
20.449
0.002
12.7631
0.0012
16.5388
0.0015
90
null
90
null
90
null
4,316.5
null
null
null
208
null
null
null
null
null
6
P c a 21
P 2c -2ac
29
bis(tris(1,2-Dimethoxyethane-O,O')-lithium) bis(μ~2~-chloro)-(μ~2~-oxo)-dich loro-tetraoxo-di-molybdenum
- C24 H60 Cl4 Li2 Mo2 O17 -
- C24 H60 Cl4 Li2 Mo2 O17 -
- C96 H240 Cl16 Li8 Mo8 O68 -
4
1
K.Harms; M.Marsch
Private Communication
2,000
null
null
null
6.76
null
null
6.76
null
null
null
null
null
null
null
null
null
has coordinates
K.Harms; M.Marsch Private Communication (2000)
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/1/10/01/1100195.cif $ #-------------------------------------------------------------------...
1,100,196
30.5918
0.0013
30.5918
0.0013
7.7464
0.001
90
null
90
null
120
null
6,278.28
null
null
null
null
null
null
null
null
null
3
R -3 :H
-R 3
148
1-(2-Hydroxyprop-2-yl)pyrene
- C19 H16 O -
- C19 H16 O -
- C342 H288 O18 -
18
1
K.Harms; M.Marsch
Private Communication
2,000
null
null
null
5.07
null
null
5.07
null
null
null
null
null
null
null
null
null
has coordinates
K.Harms; M.Marsch Private Communication (2000)
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100196.cif $ #-------------------------------------------------------------------...
1,100,197
7.163
0.002
17.466
0.006
10.565
0.003
90
null
93.9
0.03
90
null
1,318.71
null
null
null
197
null
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
Bromo(trimethyl)stibinimino-trimethylstibine
- C6 H18 Br N Sb2 -
- C6 H18 Br N Sb2 -
- C24 H72 Br4 N4 Sb8 -
4
1
U.Muller; K.Dehnicke; R.Hillwig; K.Harms; J.Pebler; A.Pilz
Private Communication
2,000
null
null
null
6.46
null
null
6.46
null
null
null
null
null
null
null
null
null
has coordinates
U.Muller; K.Dehnicke; R.Hillwig; K.Harms; J.Pebler; A.Pilz Private Communication (2000)
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100197.cif $ #-------------------------------------------------------------------...
1,100,198
7.7726
0.0006
17.7023
0.0012
15.1696
0.0014
90
null
93.518
0.01
90
null
2,083.3
null
null
null
173
null
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
tris(1,2-Dimethoxyethane)-lithium dimethyl-copper(i)
- C14 H36 Cu Li O6 -
- C14 H36 Cu Li O6 -
- C56 H144 Cu4 Li4 O24 -
4
1
John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot
The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates
Chemistry - A European Journal
2,000
6
16
3060
3068
10.1002/1521-3765(20000818)6:16<3060::AID-CHEM3060>3.0.CO;2-M
null
null
4.05
null
null
4.05
null
null
null
null
null
null
null
null
null
has coordinates
John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates Chemistry - A European Journal 6(16) (2000) 3060-3068
187,723
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-11-01 11:20:45 +0200 (Tue, 01 Nov 2016) $ #$Revision: 187723 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100198.cif $ #-------------------------------------------------------------------...
1,100,199
10.2161
0.001
19.2676
0.001
15.792
0.002
90
null
90.858
0.007
90
null
3,108.14
null
null
null
193
null
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
tris(1,2-Dimethoxyethane)-lithium bis(trimethylsilylmethyl)-copper(i)
- C20 H52 Cu Li O6 Si2 -
- C20 H52 Cu Li O6 Si2 -
- C80 H208 Cu4 Li4 O24 Si8 -
4
1
John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot
The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates
Chemistry - A European Journal
2,000
6
16
3060
3068
10.1002/1521-3765(20000818)6:16<3060::AID-CHEM3060>3.0.CO;2-M
null
null
6.65
null
null
6.65
null
null
null
null
null
null
null
null
null
has coordinates
John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates Chemistry - A European Journal 6(16) (2000) 3060-3068
187,723
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-11-01 11:20:45 +0200 (Tue, 01 Nov 2016) $ #$Revision: 187723 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/01/1100199.cif $ #-------------------------------------------------------------------...
1,100,200
10.8446
0.0007
10.9136
0.0009
18.9558
0.0012
87.682
0.009
81.637
0.008
82.658
0.009
2,200.89
null
null
null
193
null
null
null
null
null
6
P -1
-P 1
2
tetrakis(μ~2~-trimethylsilylmethylene)-tris(diethyl ether)-di-copper-di-lithium
- C28 H74 Cu2 Li2 O3 Si4 -
- C28 H74 Cu2 Li2 O3 Si4 -
- C56 H148 Cu4 Li4 O6 Si8 -
2
1
John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot
The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates
Chemistry - A European Journal
2,000
6
16
3060
3068
10.1002/1521-3765(20000818)6:16<3060::aid-chem3060>3.0.co;2-m
null
null
5.68
null
null
5.68
null
null
null
null
null
null
null
null
null
has coordinates
John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates Chemistry - A European Journal 6(16) (2000) 3060-3068
177,557
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 16:17:02 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177557 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100200.cif $ #-------------------------------------------------------------------...
1,100,201
9.018
0.0006
9.6771
0.0008
9.974
0.0007
71.564
0.005
62.985
0.005
62.938
0.005
683.92
null
null
null
213
null
null
null
null
null
5
P 1
P 1
1
(R,R)-p-Chlorophenyl-1-chloro-2-phenylethyl sulfoxide
- C14 H12 Cl2 O S -
- C14 H12 Cl2 O S -
- C28 H24 Cl4 O2 S2 -
2
2
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus
Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents
Chemistry - A European Journal
2,000
6
18
3359
3365
10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U
null
null
4.37
null
null
4.37
null
null
null
null
null
null
null
null
null
has coordinates
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal 6(18) (2000) 3359-3365
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100201.cif $ #-------------------------------------------------------------------...
1,100,202
9.1121
0.0008
9.7596
0.0007
9.9764
0.0011
84.681
0.008
62.893
0.006
63.397
0.006
699.198
null
null
null
213
null
null
null
null
null
6
P 1
P 1
1
(-)-(R,R)-p-Chlorophenyl-1-bromo-2-phenylethyl sulfoxide
- C14 H12 Br Cl O S -
- C14 H12 Br Cl O S -
- C28 H24 Br2 Cl2 O2 S2 -
2
2
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus
Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents
Chemistry - A European Journal
2,000
6
18
3359
3365
10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U
null
null
5.23
null
null
5.23
null
null
null
null
null
null
null
null
null
has coordinates
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal 6(18) (2000) 3359-3365
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100202.cif $ #-------------------------------------------------------------------...
1,100,203
6.866
0.001
9.388
0.001
11.243
0.001
90
null
103.31
0.01
90
null
705.235
null
null
null
202.15
null
null
null
null
null
5
P 21/n
14
Aminotrimethylphosphonium chloride
- C3 H11 Cl N P -
4
null
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
2.39
null
null
2.39
null
null
null
null
null
null
null
null
null
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100203.cif $ #-------------------------------------------------------------------...
1,100,204
12.736
0.004
11.488
0.003
13.02
0.003
90
null
90
null
90
null
1,904.97
null
null
null
223
null
null
null
null
null
5
P b c a
-P 2ac 2ab
61
Aminotriethylphosphonium chloride
- C6 H17 Cl N P -
- C6 H17 Cl N P -
- C48 H136 Cl8 N8 P8 -
8
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
4.19
null
null
4.19
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100204.cif $ #-------------------------------------------------------------------...
1,100,205
17.7708
0.0011
11.7355
0.0004
16.1137
0.001
90
null
115.389
0.006
90
null
3,035.94
null
null
null
190.15
null
null
null
null
null
8
P 1 21/c 1
-P 2ybc
14
Trimethylsilylaminotrimethylphosphonium trifluoromethanesulfonate
- C7 H19 F3 N O3 P S Si -
- C7 H19 F3 N O3 P S Si -
- C56 H152 F24 N8 O24 P8 S8 Si8 -
8
2
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
3.32
null
null
3.32
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100205.cif $ #-------------------------------------------------------------------...
1,100,206
8.093
0.001
17.036
0.001
18.001
0.002
90
null
96.34
0.01
90
null
2,466.66
null
null
null
223
null
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
bis(Aminotriethylphosphonium) decahydro-closo-decaborate
- C12 H44 B10 N2 P2 -
- C12 H44 B10 N2 P2 -
- C48 H176 B40 N8 P8 -
4
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
5.33
null
null
5.33
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
177,560
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 16:42:09 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177560 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100206.cif $ #-------------------------------------------------------------------...
1,100,207
8.253
0.003
10.864
0.003
12.412
0.004
114.12
0.02
104.5
0.02
93.21
0.02
967.441
null
null
null
213
null
null
null
null
null
6
P -1
-P 1
2
Aminotriphenylphosphonium dichloroiodide
- C18 H17 Cl2 I N P -
- C18 H17 Cl2 I N P -
- C36 H34 Cl4 I2 N2 P2 -
2
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
6.44
null
null
6.44
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100207.cif $ #-------------------------------------------------------------------...
1,100,208
7.121
0.001
12.333
0.002
12.571
0.002
90
null
90
null
90
null
1,104.03
null
null
null
223
null
null
null
null
null
5
P 21 21 21
P 2ac 2ab
19
Aminotriethylphosphonium iodide
- C6 H17 I N P -
- C6 H17 I N P -
- C24 H68 I4 N4 P4 -
4
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
5.76
null
null
5.76
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100208.cif $ #-------------------------------------------------------------------...
1,100,209
13.602
0.001
8.742
0.001
14.621
0.001
90
null
115.19
0.01
90
null
1,573.23
null
null
null
203
null
null
null
null
null
6
P 1 21/n 1
-P 2yn
14
Trimethylsilylaminotriethylphosphonium iodide
- C9 H25 I N P Si -
- C9 H25 I N P Si -
- C36 H100 I4 N4 P4 Si4 -
4
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
6.6
null
null
6.6
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100209.cif $ #-------------------------------------------------------------------...
1,100,210
19.254
0.009
12.6907
0.0009
15.073
0.004
90
null
111.79
0.03
90
null
3,419.89
null
null
null
213
null
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
bis(Trimethylsilyl)aminotrimethylphosphonium iodide
- C9 H27 I N P Si2 -
- C9 H27 I N P Si2 -
- C72 H216 I8 N8 P8 Si16 -
8
2
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
5.81
null
null
5.81
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100210.cif $ #-------------------------------------------------------------------...
1,100,211
25.54
0.002
13.223
0.001
11.653
0.002
90
null
90
null
90
null
3,935.4
null
null
null
223
null
null
null
null
null
6
P b c n
-P 2n 2ab
60
bis(Trimethylsilyl)aminotriethylphosphonium iodide
- C12 H33 I N P Si2 -
- C15 H42 I N P Si2 -
- C120 H336 I8 N8 P8 Si16 -
8
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
3.7
null
null
3.7
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
177,560
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 16:42:09 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177560 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100211.cif $ #-------------------------------------------------------------------...
1,100,212
9.477
0.001
10.476
0.001
16.016
0.004
90
null
105.96
0.01
90
null
1,528.79
null
null
null
223
null
null
null
null
null
6
P 1 21 1
P 2yb
4
bis(Trimethylsilyl)aminotriphenylphosphonium triiodide
- C24 H33 I3 N P Si2 -
- C24 H33 I3 N P Si2 -
- C48 H66 I6 N2 P2 Si4 -
2
1
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K.
Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^
Zeitschrift für Anorganische und Allgemeine Chemie
2,000
626
3
775
783
10.1002/(sici)1521-3749(200003)626:3<775::aid-zaac775>3.0.co;2-h
null
null
3.34
null
null
3.34
null
null
null
null
null
null
null
null
null
has coordinates
Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allg...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100212.cif $ #-------------------------------------------------------------------...
1,100,213
19.0073
0.0005
21.8155
0.0004
37.5145
0.0007
90
null
90
null
90
null
15,555.5
null
null
null
193
null
null
null
null
null
3
P n n m
-P 2 2n
58
nonakis(t-Butyl-gallium(i)) toluene solvate
- C38.31 H83.64 Ga9 -
- C58 H118 Ga11 -
- C696 H1416 Ga132 -
12
1.5
Uhl, Werner; Cuypers, Lars; Harms, Klaus; Kaim, Wolfgang; Wanner, Matthias; Winter, Rainer; Koch, Rainer; Saak, Wolfgang
Ga~9~(CMe~3~)~9~, an Important New Building Block in the Structural Chemistry of the Alkylelement(I) Compounds EnRn (E=B-In)
Zeitschrift für Anorganische und Allgemeine Chemie
2,001
40
3
566
568
10.1002/1521-3773(20010202)40:3<566::aid-anie566>3.0.co;2-t
null
null
4.54
null
null
4.54
null
null
null
null
null
null
null
null
null
has coordinates
Uhl, Werner; Cuypers, Lars; Harms, Klaus; Kaim, Wolfgang; Wanner, Matthias; Winter, Rainer; Koch, Rainer; Saak, Wolfgang Ga~9~(CMe~3~)~9~, an Important New Building Block in the Structural Chemistry of the Alkylelement(I) Compounds EnRn (E=B-In) Zeitschrift für Anorganische und Allgemeine Chemie 40(3) (2001) 566-568
177,561
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 16:51:16 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177561 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100213.cif $ #-------------------------------------------------------------------...
1,100,214
6.434
0.001
7.4927
0.0013
24.108
0.004
96.28
0.02
90.192
0.019
98.24
0.019
1,143.08
null
null
null
193
null
null
null
null
null
4
P -1
-P 1
2
(3RS,4SR,6SR,7SR)-1-Aza-9-oxa-4-phenyltricyclo(5.3.0.0^3,6^)decan-10-one
- C14 H15 N O2 -
- C16 H19 N1.5 O2 -
- C64 H76 N6 O8 -
4
2
Bach, Thorsten; Krüger, Christa; Harms, Klaus
The Stereoselective Synthesis of 2-Substituted 3-Azabicyclo[3.2.0]heptanes by Intramolecular [2+2]-Photocycloaddition Reactions
Synthesis
2,000
2,000
2
305
320
10.1055/s-2000-6261
null
null
4.52
null
null
4.52
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Krüger, Christa; Harms, Klaus The Stereoselective Synthesis of 2-Substituted 3-Azabicyclo[3.2.0]heptanes by Intramolecular [2+2]-Photocycloaddition Reactions Synthesis 2000(2) (2000) 305-320
176,882
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-25 04:41:31 +0200 (Thu, 25 Feb 2016) $ #$Revision: 176882 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100214.cif $ #-------------------------------------------------------------------...
1,100,215
10.008
0.0008
11.1636
0.0006
18.0294
0.0015
90
null
106.091
0.009
90
null
1,935.42
null
null
null
193
null
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
bis((μ~3~-Cyano)-bis(diethylether)-(trimethylsilyl)methyl-copper(i)-lithium)
- C26 H62 Cu2 Li2 N2 O4 Si2 -
- C52 H124 Cu4 Li4 N4 O8 Si4 -
- C104 H248 Cu8 Li8 N8 O16 Si8 -
2
0.5
Bosold, F.; Marsch, M.; Harms, K.; Boche, G.
Crystal structure of bis[bis(diethylether)lithium (trimethylsilyl)methyl-cyanocuprate], [(C~4~H~10~O)~2~Li(C~3~H~9~)SiCH~2~CuCN]~2~
Zeitschrift für Kristallographie - New Crystal Structures
2,001
216
1-4
143
144
10.1524/ncrs.2001.216.14.143
null
null
3.13
null
null
3.13
null
null
null
null
null
null
null
null
null
has coordinates
Bosold, F.; Marsch, M.; Harms, K.; Boche, G. Crystal structure of bis[bis(diethylether)lithium (trimethylsilyl)methyl-cyanocuprate], [(C~4~H~10~O)~2~Li(C~3~H~9~)SiCH~2~CuCN]~2~ Zeitschrift für Kristallographie - New Crystal Structures 216(1-4) (2001) 143-144
177,961
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-06 20:10:04 +0200 (Sun, 06 Mar 2016) $ #$Revision: 177961 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100215.cif $ #-------------------------------------------------------------------...
1,100,216
15.6666
0.0015
14.7993
0.001
19.6063
0.0018
90
null
105.908
0.009
90
null
4,371.72
null
null
null
193
null
null
null
null
null
8
P 1 21/n 1
-P 2yn
14
tetrakis(μ~3~-Trimethylphosphoraneiminato)-tris(trifluoromethanesulfonato-O,O')-(trifluoromethanesulfonato-O)-tetra-nickel(II)
- C16 H36 F12 N4 Ni4 O12 P4 S4 -
- C16 H36 F15 N4 Ni4 O14 P4 S4 -
- C64 H144 F60 N16 Ni16 O56 P16 S16 -
4
1
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt
Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
4
747
754
10.1002/1521-3749(200104)627:4<747::AID-ZAAC747>3.0.CO;2-H
null
null
4.43
null
null
4.43
null
null
null
null
null
null
null
null
null
has coordinates
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~] Zeitschrift fuer Anorganische und All...
176,965
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-25 13:57:03 +0200 (Thu, 25 Feb 2016) $ #$Revision: 176965 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100216.cif $ #-------------------------------------------------------------------...
1,100,217
18.407
0.001
8.101
0.001
16.072
0.002
90
null
94.74
0.01
90
null
2,388.38
null
null
null
203
null
null
null
null
null
6
C 1 2/c 1
-C 2yc
15
Dibromo-bis(tris(dimethylamino)phosphaneimine)-nickel(ii)
- C12 H38 Br2 N8 Ni P2 -
- C24 H76 Br4 N16 Ni P4 -
- C96 H304 Br16 N64 Ni4 P16 -
4
0.5
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt
Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
4
747
754
10.1002/1521-3749(200104)627:4<747::AID-ZAAC747>3.0.CO;2-H
null
null
3.4
null
null
3.4
null
null
null
null
null
null
null
null
null
has coordinates
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~] Zeitschrift fuer Anorganische und All...
176,965
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-25 13:57:03 +0200 (Thu, 25 Feb 2016) $ #$Revision: 176965 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100217.cif $ #-------------------------------------------------------------------...
1,100,218
10.531
0.002
13.15
0.003
16.745
0.003
81.547
0.013
79.148
0.016
84.912
0.018
2,248.24
null
null
null
223
null
null
null
null
null
4
P -1
-P 1
2
tetrakis(Diphenyl(methyl)phosphine)-nickel(0)
- C52 H52 Ni P4 -
- C52 H52 Ni P4 -
- C104 H104 Ni2 P8 -
2
1
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt
Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
4
747
754
10.1002/1521-3749(200104)627:4<747::AID-ZAAC747>3.0.CO;2-H
null
null
4.97
null
null
4.97
null
null
null
null
null
null
null
null
null
has coordinates
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~] Zeitschrift fuer Anorganische und All...
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100218.cif $ #-------------------------------------------------------------------...
1,100,219
12.26
0.003
16.14
0.003
24.06
0.005
90
null
92.34
0.03
90
null
4,756.94
null
null
null
null
null
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
(μ~3~-Bromo)-tris(μ~3~-tris(dimethylamino)phosphoraneiminato)-tetrabromo-tetra-nickel(ii) dichloromethane solvate
- C18.75 H55.5 Br5 Cl1.5 N12 Ni4 P3 -
- C18 H54 Br5 N12 Ni4 P3 -
- C72 H216 Br20 N48 Ni16 P12 -
4
1
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt
Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~]
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
4
747
754
10.1002/1521-3749(200104)627:4<747::AID-ZAAC747>3.0.CO;2-H
null
null
7.03
null
null
7.03
null
null
null
null
null
null
null
null
null
has coordinates
Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~] Zeitschrift fuer Anorganische und All...
176,965
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-25 13:57:03 +0200 (Thu, 25 Feb 2016) $ #$Revision: 176965 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100219.cif $ #-------------------------------------------------------------------...
1,100,220
11.0478
0.0012
28.024
0.003
7.2693
0.0007
90
null
90
null
90
null
2,250.6
null
null
null
193
null
null
null
null
null
5
I b a 2
I 2 -2c
45
(4RS,5SR,1'RS)-4-(1-Chloro-1-phenylmethyl)-5-methyl-1,3-oxazolidin-2-one
- C11 H12 Cl N O2 -
- C11 H12 Cl N O2 -
- C88 H96 Cl8 N8 O16 -
8
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
3.22
null
null
3.22
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100220.cif $ #-------------------------------------------------------------------...
1,100,221
5.3339
0.0008
12.4601
0.0017
11.8203
0.0017
90
null
93.864
0.017
90
null
783.802
null
null
null
193
null
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
(1RS,2SR,6RS)-9-Aza-2-chloro-7-oxabicyclo(4.3.0)nonan-8-one
- C7 H10 Cl N O2 -
- C7 H10 Cl N O2 -
- C28 H40 Cl4 N4 O8 -
4
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
3.45
null
null
3.45
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100221.cif $ #-------------------------------------------------------------------...
1,100,222
9.9246
0.0005
6.8908
0.0003
14.1918
0.001
90
null
95.692
0.004
90
null
965.77
null
null
null
213
null
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
(1RS,2RS,8SR)-2-Chloro-9-oxa-11-azabicyclo(6.3.0)undec-5-en-10-one
- C9 H12 Cl N O2 -
- C9 H12 Cl N O2 -
- C36 H48 Cl4 N4 O8 -
4
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
5.99
null
null
5.99
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100222.cif $ #-------------------------------------------------------------------...
1,100,223
11.9678
0.0013
6.2949
0.0003
13.7472
0.0016
90
null
113.363
0.007
90
null
950.748
null
null
null
213
null
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
(1RS,2RS,3RS)-2-Chloro-9-oxa-11-azabicyclo(6.3.0)undec-5-en-10-one
- C9 H12 Cl N O2 -
- C9 H12 Cl N O2 -
- C36 H48 Cl4 N4 O8 -
4
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
6.17
null
null
6.17
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100223.cif $ #-------------------------------------------------------------------...
1,100,224
5.6138
0.001
7.0575
0.001
15.9015
0.001
96.654
0.01
95.454
0.01
109.173
0.01
585.075
null
null
null
213
null
null
null
null
null
4
P -1
-P 1
2
4-(4-n-Butyltetrahydro-3-furyl)-1,3-oxazolidin-2-one
- C11 H19 N O3 -
- C15 H31 N O3 -
- C30 H62 N2 O6 -
2
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
6.88
null
null
6.88
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
177,553
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-04 15:51:45 +0200 (Fri, 04 Mar 2016) $ #$Revision: 177553 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100224.cif $ #-------------------------------------------------------------------...
1,100,225
6.9144
0.0006
9.352
0.003
19.9486
0.0011
90
null
99.398
0.009
90
null
1,272.63
null
null
null
213
null
null
null
null
null
5
P 1 21/n 1
-P 2yn
14
(Z)-4-(1-Chloro-1-phenylmethylidene)-5-propyl-1,3-oxazolidin-2-one
- C13 H14 Cl N O2 -
- C13 H14 Cl N O2 -
- C52 H56 Cl4 N4 O8 -
4
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
5.93
null
null
5.93
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100225.cif $ #-------------------------------------------------------------------...
1,100,226
9.3539
0.0008
9.4338
0.0006
10.2406
0.0005
91.805
0.006
104.889
0.007
109.986
0.006
813.611
null
null
null
213
null
null
null
null
null
4
P -1
-P 1
2
(Z)-5-Cyclohexyl-4-(1-(2,2-dimethylpropylidene))-5-ethoxy-1,3-oxazolidin-2-one
- C16 H27 N O3 -
- C16 H27 N O3 -
- C32 H54 N2 O6 -
2
1
Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal
2,001
7
12
2581
2594
10.1002/1521-3765(20010618)7:12<2581::aid-chem25810>3.0.co;2-o
null
null
5.71
null
null
5.71
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100226.cif $ #-------------------------------------------------------------------...
1,100,227
11.818
0.0015
9.9465
0.001
16.082
0.0019
90
null
110.375
0.009
90
null
1,772.13
null
null
null
203
null
null
null
null
null
4
P 1 21/n 1
-P 2yn
14
(1RS,5SR,7SR)-3-Aza-2-oxo-1,5,7-trimethylbicyclo[3.3.1]-7-nonanoic acid 3-form ylphenyl ester
- C19 H23 N O4 -
- C19 H23 N O4 -
- C76 H92 N4 O16 -
4
1
Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus
The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes
Chemistry - A European Journal
2,001
7
20
4512
4521
10.1002/1521-3765(20011015)7:20<4512::aid-chem4512>3.0.co;2-h
null
null
5.76
null
null
5.76
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes Chemistry - A European Journal 7(20) (2001) 4512-4521
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100227.cif $ #-------------------------------------------------------------------...
1,100,228
13.857
0.002
7.9815
0.0008
15.117
0.002
90
null
113.252
0.015
90
null
1,536.14
null
null
null
193
null
null
null
null
null
4
P 1 21/n 1
-P 2yn
14
(1RS,5RS,6SR)-4-methyl-8,8-diphenyl-7-oxa-2-azabicyclo[4.2.0]octan-3-one
- C19 H19 N O2 -
- C19 H19 N O2 -
- C76 H76 N4 O8 -
4
1
Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus
The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes
Chemistry - A European Journal
2,001
7
20
4512
4521
10.1002/1521-3765(20011015)7:20<4512::aid-chem4512>3.0.co;2-h
null
null
3.64
null
null
3.64
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes Chemistry - A European Journal 7(20) (2001) 4512-4521
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100228.cif $ #-------------------------------------------------------------------...
1,100,229
7.699
0.0011
13.7214
0.0019
18.8308
0.0014
89.963
0.016
80.265
0.016
76.44
0.017
1,904.43
null
null
null
193
null
null
null
null
null
5
P -1
-P 1
2
(1RS,6SR)-8,8-diphenyl-7-oxa-2-azabicyclo[4.2.0]octan-3-one chloroform solvate
- C19 H18 Cl3 N O2 -
- C19 H18 Cl3 N O2 -
- C76 H72 Cl12 N4 O8 -
4
2
Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus
The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes
Chemistry - A European Journal
2,001
7
20
4512
4521
10.1002/1521-3765(20011015)7:20<4512::aid-chem4512>3.0.co;2-h
null
null
5.79
null
null
5.79
null
null
null
null
null
null
null
null
null
has coordinates
Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes Chemistry - A European Journal 7(20) (2001) 4512-4521
301,773
2025-08-18
12:42:41
#------------------------------------------------------------------------------ #$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/1/10/02/1100229.cif $ #-------------------------------------------------------------------...
1,100,230
15.929
0.002
9.438
0.001
14.13
0.002
90
null
90
null
90
null
2,124.27
null
null
null
293
null
null
null
null
null
5
P n a 21
P 2c -2n
33
Dibromo-tetrapyridine-nickel(ii)
- C20 H20 Br2 N4 Ni -
- C20 H20 Br2 N4 Ni -
- C80 H80 Br8 N16 Ni4 -
4
1
Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt
Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~
Zeitschrift fuer Anorganische und Allgemeine Chemie
2,001
627
8
1928
1931
10.1002/1521-3749(200108)627:8<1928::AID-ZAAC1928>3.0.CO;2-V
null
null
4.92
null
null
4.92
null
null
null
null
null
null
null
null
null
has coordinates
Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~ Zeitschrift fuer Anorganische und Allgemeine Chemie 627(8) (2001) 1928-1931
176,963
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-25 13:46:45 +0200 (Thu, 25 Feb 2016) $ #$Revision: 176963 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/10/02/1100230.cif $ #-------------------------------------------------------------------...