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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=62971 Help
TitleStructures of thionyl halides: S O Cl2 and S O Br2..
AuthorsMootz, D.;Merschenz Quack, A.
ReferenceIC&volume=44&fpage=926&details=yes target=icsd_help>Acta Crystallographica C (1988) 44, 926-927
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CompoundCl2 O1 S1 - Thionyl dichloride [AXY2] [mP16] [e4] []
Cell8.8373(9), 5.8033(6), 7.5862(8), 90., 100.064(8), 90.
P121/C1 (14) V=383.08
RemarksR=0.025000 : T =143 :
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.
Anisotropic temperature factors have been deposited with the Br
Temperature factors for all atoms as B eq.

Atom (site) Oxid. x, y, z, B, Occupancy
Cl1(4e)-1
Cl2(4e)-1
S1(4e)4
O1(4e)-2
0.250.270.402.391
0.370.700.232.331
0.160.560.251.511
0.090.710.372.561

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