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1 entry selected.
CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=48185 Help
TitleStructural Characterisation of trans-(Cr (N H3)4 (H2 O) Cl) Cl2 and trans-(Cr (N H3)4 Cl2) I.
AuthorsBrencic, J.V.;Leban, I.;Zule, J.
ReferenceZeitschrift fuer Anorganische und Allgem (1985) 521, 199-206
Link XRef SCOPUS Google
CompoundH14 Cl3 Cr1 N4 O1 - Tetraammineaquachlorochromium chloride [AXY3Z4] [mP46] [f2 e5] []
Cell6.556(1), 10.630(5), 6.729(2), 90., 96.15(3), 90.
P121/M1 (11) V=466.25
RemarksR=0.023000 :
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
Cr1(2e)3
Cl1(2e)-1
Cl2(4f)-1
N1(4f)-3
H1(4f)1
H2(4f)1
H3(4f)1
N2(2e)-3
H4(4f)1
H5(2e)1
N3(2e)-3
H6(4f)1
H7(2e)1
O1(2e)-2
H8(4f)1
0.170.250.2201
-.060.25-.0501
0.680.510.2801
0.180.440.2201
0.200.470.100.091
0.040.470.220.091
0.260.460.310.091
-.050.250.4101
-.140.180.370.091
-.010.250.550.091
0.420.250.0501
0.400.190.030.091
0.450.250.170.091
0.380.250.4601
0.370.180.530.091
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Cr1(2e)3
Cl1(2e)-1
Cl2(4f)-1
N1(4f)-3
H1(4f)1
H2(4f)1
H3(4f)1
N2(2e)-3
H4(4f)1
H5(2e)1
N3(2e)-3
H6(4f)1
H7(2e)1
O1(2e)-2
H8(4f)1
0.020.010.0100.000
0.020.030.020-.000
0.030.020.03-.000.000.00
0.030.020.030.00-.00-.00
000000
000000
000000
0.030.030.0200.000
000000
000000
0.030.030.0300.000
000000
000000
0.030.020.020-.000
000000

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