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2-[[3-(trifluoromethyl)phenyl]amino] benzoic acid(FLF) Summary

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  • 2-[[3-(trifluoromethyl)phenyl]amino] benzoic acid(FLF) Summary
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Dihedrals Table
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Dih. Atom names Experimental Type
1 C1.1-C2.3-C3.4-C4.65-3-2-0 C1.6-C2.4-C3.3-C4.1 -0.643 Rigid Ring
2 C1.1-C6.8-C5.7-C4.65-6-7-0 C1.6-C6.7-C5.8-C4.1 -2.162 Rigid Ring
3 C1.1-C6.8-N.10-C1'.1110-9-7-0 C1.11-C6.10-N.8-C1'.1 147.305 Flexible
4 C2.3-C1.1-C6.8-C5.76-7-0-2 C2.7-C1.8-C6.1-C5.3 2.189 Rigid Ring
5 C2.3-C1.1-C6.8-N.109-7-0-2 C2.10-C1.8-C6.1-N.3 -179.935 Rigid
6 C2.3-C1.1-C7.9-O1.21-8-0-2 C2.2-C1.9-C7.1-O1.3 -176.151 Flexible
7 C2.3-C1.1-C7.9-O2.54-8-0-2 C2.5-C1.9-C7.1-O2.3 3.518 Flexible
8 C2.3-C3.4-C4.6-C5.76-5-3-2 C2.7-C3.6-C4.4-C5.3 0.72 Rigid Ring
9 C3.4-C4.6-C5.7-C6.87-6-5-3 C3.8-C4.7-C5.6-C6.4 0.699 Rigid Ring
10 C4.6-C5.7-C6.8-N.109-7-6-5 C4.10-C5.8-C6.7-N.6 179.994 Rigid
11 C5.7-C6.8-N.10-C1'.1110-9-7-6 C5.11-C6.10-N.8-C1'.7 -34.875 Flexible
12 C6.8-C1.1-C2.3-C3.43-2-0-7 C6.4-C1.3-C2.1-C3.8 -0.831 Rigid Ring
13 C6.8-C1.1-C7.9-O1.21-8-0-7 C6.2-C1.9-C7.1-O1.8 3.511 Flexible
14 C6.8-C1.1-C7.9-O2.54-8-0-7 C6.5-C1.9-C7.1-O2.8 -176.82 Flexible
15 C6.8-N.10-C1'.11-C2'.1211-10-9-7 C6.12-N.11-C1'.10-C2'.8 169.54 Flexible
16 C6.8-N.10-C1'.11-C6'.1615-10-9-7 C6.16-N.11-C1'.10-C6'.8 -7.544 Flexible
17 C7.9-C1.1-C2.3-C3.43-2-0-8 C7.4-C1.3-C2.1-C3.9 178.843 Rigid
18 C7.9-C1.1-C6.8-C5.76-7-0-8 C7.7-C1.8-C6.1-C5.9 -177.474 Rigid
19 C7.9-C1.1-C6.8-N.109-7-0-8 C7.10-C1.8-C6.1-N.9 0.403 Rigid
20 N.10-C1'.11-C2'.12-C3'.1312-11-10-9 N.13-C1'.12-C2'.11-C3'.10 -177.358 Rigid
21 N.10-C1'.11-C6'.16-C5'.1514-15-10-9 N.15-C1'.16-C6'.11-C5'.10 177.44 Rigid
22 C1'.11-C2'.12-C3'.13-C4'.1413-12-11-10 C1'.14-C2'.13-C3'.12-C4'.11 -0.277 Rigid Ring
23 C1'.11-C2'.12-C3'.13-C7'.1716-12-11-10 C1'.17-C2'.13-C3'.12-C7'.11 -178.522 Rigid
24 C1'.11-C6'.16-C5'.15-C4'.1413-14-15-10 C1'.14-C6'.15-C5'.16-C4'.11 -0.268 Rigid Ring
25 C2'.12-C1'.11-C6'.16-C5'.1514-15-10-11 C2'.15-C1'.16-C6'.11-C5'.12 0.362 Rigid Ring
26 C2'.12-C3'.13-C4'.14-C5'.1514-13-12-11 C2'.15-C3'.14-C4'.13-C5'.12 0.375 Rigid Ring
27 C2'.12-C3'.13-C7'.17-F1.1817-16-12-11 C2'.18-C3'.17-C7'.13-F1.12 -30.013 Flexible
28 C2'.12-C3'.13-C7'.17-F2.1918-16-12-11 C2'.19-C3'.17-C7'.13-F2.12 -149.979 Flexible
29 C2'.12-C3'.13-C7'.17-F3.2019-16-12-11 C2'.20-C3'.17-C7'.13-F3.12 90.849 Flexible
30 C3'.13-C2'.12-C1'.11-C6'.1615-10-11-12 C3'.16-C2'.11-C1'.12-C6'.13 -0.088 Rigid Ring
31 C3'.13-C4'.14-C5'.15-C6'.1615-14-13-12 C3'.16-C4'.15-C5'.14-C6'.13 -0.111 Rigid Ring
32 C4'.14-C3'.13-C7'.17-F1.1817-16-12-13 C4'.18-C3'.17-C7'.13-F1.14 151.776 Flexible
33 C4'.14-C3'.13-C7'.17-F2.1918-16-12-13 C4'.19-C3'.17-C7'.13-F2.14 31.81 Flexible
34 C4'.14-C3'.13-C7'.17-F3.2019-16-12-13 C4'.20-C3'.17-C7'.13-F3.14 -87.362 Flexible
35 C5'.15-C4'.14-C3'.13-C7'.1716-12-13-14 C5'.17-C4'.13-C3'.14-C7'.15 178.617 Rigid
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