Table 1 Details on the single crystal refinement of Sr2Co3S2O3 at room temperature.

From: Coexistence of spin ordering on ladders and spin dimer formation in a new-structure-type compound Sr2Co3S2O3

Empirical formula

Sr2Co3S2O3

Crystal system

Orthorhombic

Space group

Pbam (No. 55)

Z

2

a (Å)

7.50285(4)

b (Å)

9.79549(5)

c (Å)

3.99006(2)

V (Å3)

293.246(3)

Calculated density (g/cm3)

5.2567

Range of data collection

3.42 ≤ 2θ ≤ 65.84

No. of measured reflections

2785

No. of independent reflections

1552

No. of refined parameters

33

h, k, l ranges

0 ≤ h ≤ 19, 0 ≤ k ≤ 25, 0 ≤ l ≤ 10

μ (mm−1)

27.024

R(obs), Rw(obs)

0.033, 0.090

R(all), Rw(all)

0.050, 0.14

Goodness of fit

0.70

Final difference density

+0.90/−2.78

Data base - CSD number a

431714

  1. aFurther details of the crystal structure investigations may be obtained from FIZ Karlsruhe, 76344 Eggenstein-Leopoldshafen, Germany (fax: (+49)7247-808-666; e-mail: crysdata@fiz-karlsruhe.de, on quoting the CSD numbers).
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