ICSD for WWW

Details of the selected entries


1 entry selected.
CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
***Click the ANX, Pearson or Wyckoff Symbol to find structures with that symbol***.
CC=52141 Help
TitlePhase transitions and structures at 10, 92, and 203 K in eight trigonal double salts M(I) (M(II) (NH4)6) (ClO4)2 X2.
AuthorsFiggis, B.N.; Sobolev, A.N.; Reynolds, P.A.
ReferenceIC&volume=54&fpage=613&details=yes target=icsd_help>Acta Crystallographica B (1998) 54, 613-625
Link XRef SCOPUS Google
CompoundH18 Cl4 N6 O8 Rb1 Ru1 - Rubidium hexaammineruthenium(III) dichloride bis(chlorate(VII)) [ABC2X2Y6Z8] [hR38] [f2 c3 b a] []
Cell7.104(1), 7.104, 27.408(7), 90., 90., 120.
R3-H (148) V=1197.88
RemarksR=0.024500 : T =92 : M =Cl :
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.

Atom (site) Oxid. x, y, z, B, Occupancy
Ru1(3a)3
N1(18f)-3
Rb1(3b)1
Cl1(6c)-1
Cl2(6c)7
O1(6c)-2
O2(18f)-2
H1(18f)1
H2(18f)1
H3(18f)1
0000.001
0.16-.11-.040.011.
000.50.011
000.370.011
000.180.001
000.130.011
0.08-.130.200.011
0.17-.21-.020.021
0.29-.00-.050.021
0.09-.18-.060.021
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Ru1(3a)3
N1(18f)-3
Rb1(3b)1
Cl1(6c)-1
Cl2(6c)7
O1(6c)-2
O2(18f)-2
H1(18f)1
H2(18f)1
H3(18f)1
0.000.000.000.0000
0.010.010.010.000.00-0.0
0.010.010.010.0000
0.010.010.010.0000
0.000.000.000.0000
0.020.020.000.0100
0.010.010.010.010.000.00
000000
000000
000000

Demo database
Copying or publishing either the ICSD data or software without written permission is illegal.
The ICSD database is copyright © 2018 by Fachinformationszentrum (FIZ) Karlsruhe
The PHP-mySQL WWW interface is copyright © 2003-2015 by Peter Hewat
The 3D crystal structure visualisation software, xtal-3d is copyright © 1994-2015 by Marcus Hewat
The PHP-JMOL drawing software is copyright © 2006-2015 by Alan Hewat
Please report technical problems with ICSD for WWW to alan.hewat[a]neutronoptics.com (Alan Hewat).