Synthese und Charakterisierung neuer Schwefel-Tripodliganden für ...

ANHANG - Kristallstrukturdaten 113
I. Kristallstrukturdaten von fac-[W(κ 3 -1)(CO)3]
Tabelle 1: Kristalldaten und Verfeinerungsparameter für i0034
Identification code i0034
Empirical formula C15 H20 O3 S3 Si W
Formula weight 556.43
Temperature 213(2) K
Wavelength 0.71073 Å
Crystal system Monoclinic
Space group P21/c
Unit cell dimensions a = 13.1471(8) Å alpha = 90°
b = 23.7606(19) Å beta = 103.895(5)°
c = 12.7676(8) Å gamma = 90°
Volume 3871.7(5) A 3
Z 8
Density (calculated) 1.909 g/cm 3
Absorption coefficient 6.362 mm -1