Ylid
Christensen A T, Thom E
Acta Crystallographica B27 (1971) 581-586
The crystal structure of 2-dimenthylsulfuranylidene-1,3-indanedione
_database_code_amcsd 0009387
CELL PARAMETERS: 18.3310 9.0120 5.9490 90.000 90.000 90.000
SPACE GROUP: P2_12_12_1
X-RAY WAVELENGTH: 1.541838
Cell Volume: 982.769
Density (g/cm3): 1.394
MAX. ABS. INTENSITY / VOLUME**2: 2.671792786
RIR: 0.624
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
9.65 17.60 9.1655 2 0 0 2
10.94 31.25 8.0875 1 1 0 4
13.78 83.23 6.4260 2 1 0 4
15.66 13.07 5.6585 1 0 1 4
17.54 18.10 5.0574 3 1 0 4
17.77 3.33 4.9900 2 0 1 4
17.87 1.49 4.9648 0 1 1 4
18.51 55.48 4.7922 1 1 1 4
19.37 6.18 4.5827 4 0 0 2
20.29 16.35 4.3757 1 2 0 4
20.34 96.71 4.3655 2 1 1 4
20.84 21.92 4.2625 3 0 1 4
21.76 3.24 4.0849 4 1 0 4
21.98 73.34 4.0437 2 2 0 4
23.08 100.00 3.8532 3 1 1 4
25.27 11.21 3.5249 1 2 1 4
26.24 4.35 3.3959 5 1 0 4
26.47 26.47 3.3675 4 1 1 4
26.66 45.10 3.3443 2 2 1 4
27.77 1.60 3.2130 4 2 0 4
28.60 6.26 3.1211 5 0 1 4
28.83 1.53 3.0965 3 2 1 4
30.04 7.49 2.9745 0 0 2 2
30.31 11.18 2.9492 5 1 1 4
30.44 1.47 2.9361 1 0 2 4
30.90 7.14 2.8934 6 1 0 4
31.46 4.69 2.8438 5 2 0 4
31.62 7.72 2.8292 2 0 2 4
31.65 21.85 2.8270 4 2 1 4
31.68 2.02 2.8246 0 1 2 4
33.19 13.55 2.6993 2 1 2 4
33.42 5.21 2.6815 0 3 1 4
33.51 10.84 2.6744 3 0 2 4
34.47 3.51 2.6020 6 1 1 4
34.86 15.36 2.5736 2 3 1 4
34.97 14.01 2.5657 5 2 1 4
35.70 2.73 2.5147 7 1 0 4
35.74 1.14 2.5124 4 3 0 4
36.53 1.87 2.4600 1 2 2 4
36.60 3.84 2.4555 3 3 1 4
37.40 3.17 2.4046 4 1 2 4
37.53 5.35 2.3968 7 0 1 4
37.54 1.79 2.3961 2 2 2 4
38.88 6.67 2.3163 7 1 1 4
38.91 6.92 2.3144 4 3 1 4
39.17 3.34 2.2999 3 2 2 4
40.02 1.71 2.2530 0 4 0 2
40.31 3.06 2.2375 5 1 2 4
40.33 5.92 2.2362 1 4 0 4
41.36 4.21 2.1827 4 2 2 4
42.73 1.14 2.1161 7 2 1 4
42.78 1.14 2.1139 3 4 0 4
42.78 3.51 2.1136 0 3 2 4
43.50 2.56 2.0805 8 1 1 4
43.64 5.51 2.0740 6 1 2 4
44.05 5.77 2.0555 5 2 2 4
44.10 2.11 2.0534 2 4 1 4
45.54 1.31 1.9919 3 4 1 4
45.98 1.28 1.9740 7 3 0 4
47.04 3.67 1.9318 8 2 1 4
47.16 1.18 1.9270 9 0 1 4
47.17 1.17 1.9266 6 2 2 4
47.19 1.79 1.9260 1 1 3 4
47.34 2.90 1.9204 7 1 2 4
47.36 1.36 1.9193 4 3 2 4
47.50 2.18 1.9143 4 4 1 4
48.30 1.15 1.8844 9 1 1 4
48.60 1.82 1.8735 7 3 1 4
49.74 1.20 1.8331 10 0 0 2
52.22 4.30 1.7518 10 0 1 4
52.46 3.60 1.7442 5 0 3 4
52.66 2.73 1.7382 6 3 2 4
52.78 1.19 1.7345 6 4 1 4
53.09 2.42 1.7250 0 5 1 4
53.15 1.26 1.7231 3 4 2 4
53.35 1.26 1.7174 1 5 1 4
54.10 1.39 1.6952 2 5 1 4
54.37 2.24 1.6875 4 2 3 4
55.34 1.05 1.6601 3 5 1 4
55.90 4.21 1.6447 7 3 2 4
57.05 1.47 1.6144 4 5 1 4
57.11 1.15 1.6128 5 4 2 4
58.37 1.16 1.5809 7 0 3 4
61.36 1.47 1.5109 9 4 0 4
62.10 1.27 1.4947 3 5 2 4
62.23 1.08 1.4917 7 2 3 4
62.38 1.02 1.4885 0 4 3 4
62.73 1.11 1.4811 7 4 2 4
63.29 1.14 1.4693 2 4 3 4
64.29 1.24 1.4489 2 1 4 4
65.72 1.15 1.4208 9 0 3 4
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.