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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
429091 |
135168812 |
2 |
NH23C34 |
AB23C34 |
301.29 |
0.9 |
-7.94 |
-0.47 |
0 |
|
|
429092 |
135168814 |
2 |
NH21C31 |
AB21C31 |
275.38 |
2.43 |
-8.03 |
-0.5 |
0 |
|
|
429093 |
135168815 |
2 |
NH22C33 |
AB22C33 |
298.93 |
1.3 |
-8.1 |
-0.58 |
0 |
|
|
429094 |
135168816 |
2 |
NH25C37 |
AB25C37 |
372.56 |
1.7 |
-8.1 |
-0.9 |
0 |
|
|
429095 |
135168817 |
1 |
ON2H48C74 |
AB2C48D74 |
451.45 |
2.04 |
-7.9 |
-1.01 |
0 |
|
|
429096 |
135168818 |
2 |
NH24C36 |
AB24C36 |
367.37 |
2.22 |
-8.03 |
-0.8 |
0 |
|
|
429097 |
135168819 |
2 |
NH23C34 |
AB23C34 |
301.22 |
1.68 |
-8.1 |
-0.59 |
0 |
|
|
429098 |
135168820 |
2 |
NH23C34 |
AB23C34 |
298.03 |
2.16 |
-7.92 |
-0.54 |
0 |
|
|
429099 |
135168828 |
1 |
ON2H48C80 |
AB2C48D80 |
329.86 |
1.69 |
-8.05 |
-0.55 |
0 |
|
|
429100 |
135168829 |
1 |
N2H50C71 |
A2B50C71 |
337.07 |
1.78 |
-7.9 |
-0.86 |
0 |
|
|
429101 |
135168830 |
2 |
NH23C34 |
AB23C34 |
348.96 |
2.88 |
-7.9 |
-0.8 |
0 |
|
|
429102 |
135168837 |
2 |
NH21C34 |
AB21C34 |
307.38 |
0.89 |
-7.99 |
-0.46 |
0 |
|
|
429103 |
135168838 |
2 |
NH25C40 |
AB25C40 |
352.35 |
1.24 |
-7.96 |
-0.57 |
0 |
|
|
429104 |
135168839 |
2 |
NH21C34 |
AB21C34 |
310.02 |
1.22 |
-8.01 |
-0.61 |
0 |
|
|
429105 |
135168892 |
2 |
NH24C39 |
AB24C39 |
347.1 |
1.24 |
-8.1 |
-0.64 |
0 |
|
|
429106 |
135168893 |
2 |
NH25C39 |
AB25C39 |
344.47 |
1.46 |
-8.06 |
-0.65 |
0 |
|
|
429107 |
135168894 |
2 |
NH24C39 |
AB24C39 |
347.94 |
0.68 |
-8.05 |
-0.62 |
0 |
|
|
429108 |
135168895 |
2 |
NH25C39 |
AB25C39 |
343.81 |
1.79 |
-8.09 |
-0.64 |
0 |
|
|
429109 |
135168896 |
2 |
NH22C36 |
AB22C36 |
324.58 |
0.77 |
-8.05 |
-0.62 |
0 |
|
|
429110 |
135168897 |
2 |
NH26C41 |
AB26C41 |
367.17 |
2.25 |
-8.03 |
-0.61 |
0 |
|
|
429111 |
135168898 |
2 |
NH23C36 |
AB23C36 |
321.3 |
0.8 |
-8.06 |
-0.59 |
0 |
|
|
429112 |
135168899 |
2 |
NH24C38 |
AB24C38 |
341.44 |
1.36 |
-8.03 |
-0.58 |
0 |
|
|
429113 |
135168900 |
2 |
NH27C42 |
AB27C42 |
368.26 |
0.33 |
-7.99 |
-0.68 |
0 |
|
|
429114 |
135168901 |
2 |
NH25C39 |
AB25C39 |
342.42 |
1.24 |
-8.02 |
-0.73 |
0 |
|
|
429115 |
135168902 |
2 |
NH26C41 |
AB26C41 |
362.83 |
0.39 |
-7.89 |
-0.82 |
0 |
|
|
429116 |
135168903 |
2 |
NH23C36 |
AB23C36 |
319.13 |
0.32 |
-7.97 |
-0.68 |
0 |
|
|
429117 |
135168904 |
2 |
NH24C38 |
AB24C38 |
336.77 |
0.38 |
-8.02 |
-0.68 |
0 |
|
|
429118 |
135168905 |
1 |
N2H54C81 |
A2B54C81 |
333.29 |
0.84 |
-8.03 |
-0.62 |
0 |
|
|
429119 |
135168906 |
1 |
ON2H52C84 |
AB2C52D84 |
341.61 |
0.68 |
-7.92 |
-0.72 |
0 |
|
|
429120 |
135168907 |
2 |
NH27C42 |
AB27C42 |
368.58 |
1.74 |
-8.07 |
-0.65 |
0 |
|
|
429121 |
135168908 |
2 |
NH25C39 |
AB25C39 |
347.16 |
1.1 |
-8.07 |
-0.63 |
0 |
|
|
429122 |
135168909 |
2 |
NH27C42 |
AB27C42 |
371.05 |
1.25 |
-8.09 |
-0.66 |
0 |
|
|
429123 |
135168910 |
1 |
ON2H52C84 |
AB2C52D84 |
341.78 |
1.32 |
-8.02 |
-0.73 |
0 |
|
|
429124 |
135168911 |
2 |
NH25C39 |
AB25C39 |
344.73 |
0.41 |
-7.99 |
-0.61 |
0 |
|
|
429125 |
135168912 |
1 |
N2H54C81 |
A2B54C81 |
491.72 |
1.31 |
-7.82 |
-1.04 |
0 |
|
|
429126 |
135168913 |
2 |
NH25C39 |
AB25C39 |
341.75 |
0.42 |
-7.95 |
-0.73 |
0 |
|
|
429127 |
135168914 |
1 |
N2H50C81 |
A2B50C81 |
367.3 |
1.48 |
-8.06 |
-0.55 |
0 |
|
|
429128 |
135168915 |
1 |
N2H50C81 |
A2B50C81 |
363.76 |
1.85 |
-7.88 |
-0.54 |
0 |
|
|
429129 |
135168916 |
1 |
N2H50C81 |
A2B50C81 |
365.29 |
0.63 |
-7.93 |
-0.55 |
0 |
|
|
429130 |
135168917 |
1 |
N2H50C81 |
A2B50C81 |
366.12 |
1.41 |
-8.12 |
-0.47 |
0 |
|
|
429131 |
135168918 |
1 |
N2H54C81 |
A2B54C81 |
357.05 |
1.8 |
-7.95 |
-0.52 |
0 |
|
|
429132 |
135168919 |
1 |
N2H54C81 |
A2B54C81 |
509.83 |
2.67 |
-7.93 |
-1.04 |
0 |
|
|
429133 |
135168920 |
1 |
N2H54C81 |
A2B54C81 |
408.8 |
1.97 |
-8.13 |
-0.88 |
0 |
|
|
429134 |
135168921 |
1 |
N2H54C81 |
A2B54C81 |
409.61 |
10.95 |
-6.71 |
-1.87 |
0 |
|
|
429135 |
135168922 |
1 |
N2H50C81 |
A2B50C81 |
369.84 |
1.34 |
-8.19 |
-0.55 |
0 |
|
|
429136 |
135168923 |
1 |
N2H52C81 |
A2B52C81 |
513.83 |
2.98 |
-7.91 |
-1.02 |
0 |
|
|
429137 |
135168924 |
1 |
N2H50C81 |
A2B50C81 |
436.81 |
2.08 |
-8.1 |
-0.56 |
0 |
|
|
429138 |
135168925 |
1 |
N2H52C81 |
A2B52C81 |
361.87 |
2.14 |
-8.0 |
-0.53 |
0 |
|
|
429139 |
135168926 |
1 |
N2H54C81 |
A2B54C81 |
362.98 |
1.41 |
-7.89 |
-0.52 |
0 |
|
|
429140 |
135168927 |
1 |
N2H52C81 |
A2B52C81 |
411.02 |
1.73 |
-7.9 |
-0.8 |
0 |
|
|
429141 |
135168929 |
1 |
N2H54C81 |
A2B54C81 |
415.24 |
10.4 |
-6.67 |
-1.82 |
0 |
|
|
429142 |
135168930 |
1 |
O3N7C27H35 |
A3B7C27D35 |
-49.4 |
4.97 |
-8.95 |
-0.96 |
0 |
|
|
429143 |
135168931 |
2 |
NH22C35 |
AB22C35 |
308.59 |
1.27 |
-7.96 |
-0.56 |
0 |
|
|
429144 |
135168932 |
1 |
N2H30C43 |
A2B30C43 |
190.96 |
1.78 |
-8.0 |
-0.59 |
0 |
|
|
429145 |
135168933 |
1 |
N3H51C80 |
A3B51C80 |
359.37 |
1.15 |
-7.94 |
-0.63 |
0 |
|
|
429146 |
135168934 |
1 |
NH27C39 |
AB27C39 |
160.84 |
0.94 |
-8.0 |
-0.59 |
0 |
|
|
429147 |
135168938 |
1 |
NH35C56 |
AB35C56 |
245.05 |
0.45 |
-8.07 |
-0.67 |
0 |
|
|
429148 |
135168939 |
2 |
NH21C33 |
AB21C33 |
295.31 |
1.04 |
-7.9 |
-0.61 |
0 |
|
|
429149 |
135168940 |
2 |
NH24C37 |
AB24C37 |
426.82 |
1.14 |
-7.91 |
-0.73 |
0 |
|
|
429150 |
135168941 |
1 |
N3H47C74 |
A3B47C74 |
347.92 |
1.05 |
-8.02 |
-0.61 |
0 |
|
|
429151 |
135168942 |
1 |
N2O2C11H12 |
A2B2C11D12 |
-34.9 |
5.45 |
-9.13 |
-0.18 |
0 |
|
|
429152 |
135168943 |
1 |
O4N6C27H30 |
A4B6C27D30 |
-74.43 |
4.41 |
-9.0 |
-0.56 |
0 |
|
|
429153 |
135168944 |
1 |
O3N7C27H33 |
A3B7C27D33 |
-53.57 |
5.45 |
-8.98 |
-0.49 |
0 |
|
|
429154 |
135168945 |
1 |
O3N6C32H32 |
A3B6C32D32 |
-7.35 |
7.59 |
-9.2 |
-0.71 |
0 |
|
|
429155 |
135168946 |
1 |
O3N7C25H27 |
A3B7C25D27 |
-16.01 |
6.41 |
-9.2 |
-0.82 |
0 |
|
|
429156 |
135168947 |
1 |
O3N5F6H19C21 |
A3B5C6D19E21 |
-368.2 |
10.03 |
-9.17 |
-0.85 |
0 |
|
|
429157 |
135168948 |
1 |
O3N7C26H29 |
A3B7C26D29 |
-29.23 |
8.88 |
-9.0 |
-0.64 |
0 |
|
|
429158 |
135168949 |
1 |
FO3N6C26H33 |
AB3C6D26E33 |
-133.32 |
4.65 |
-8.95 |
-0.48 |
0 |
|
|
429159 |
135168994 |
1 |
ClO3N5C27H34 |
AB3C5D27E34 |
-104.47 |
4.5 |
-8.91 |
-0.44 |
0 |
|
|
429160 |
135169007 |
1 |
FO3N6C27H29 |
AB3C6D27E29 |
-94.91 |
3.3 |
-8.99 |
-0.49 |
0 |
|
|
429161 |
135169008 |
1 |
ClO3N7C26H28 |
AB3C7D26E28 |
-41.32 |
4.06 |
-8.84 |
-1.0 |
0 |
|
|
429162 |
135169009 |
1 |
ClO3N5H24C25 |
AB3C5D24E25 |
-37.76 |
8.88 |
-9.16 |
-0.37 |
0 |
|
|
429163 |
135169010 |
1 |
ClO3N6H23C24 |
AB3C6D23E24 |
-26.59 |
7.01 |
-9.15 |
-0.77 |
0 |
|
|
429164 |
135169011 |
3 |
ON2C9H10 |
AB2C9D10 |
-43.37 |
3.04 |
-8.85 |
-0.33 |
0 |
|
|
429165 |
135169012 |
1 |
FO3N6C26H27 |
AB3C6D26E27 |
-81.55 |
4.0 |
-9.0 |
-0.59 |
0 |