List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
373042 |
131308983 |
1 |
ON3C12H15 |
AB3C12D15 |
57.58 |
2.89 |
-9.81 |
-0.55 |
0 |
|
|
373043 |
131309006 |
1 |
ClO2C8H11 |
AB2C8D11 |
-81.61 |
2.48 |
-9.74 |
-0.64 |
0 |
|
|
373044 |
131309023 |
1 |
BrO2N4H7C9 |
AB2C4D7E9 |
13.62 |
5.03 |
-10.23 |
-1.74 |
0 |
|
|
373045 |
131309024 |
1 |
BrO2N4H7C9 |
AB2C4D7E9 |
23.02 |
4.88 |
-10.08 |
-1.82 |
0 |
|
|
373046 |
131309059 |
1 |
BrON2H7C11 |
ABC2D7E11 |
79.29 |
6.56 |
-9.94 |
-1.14 |
0 |
|
|
373047 |
131309064 |
1 |
BrON2H7C11 |
ABC2D7E11 |
44.37 |
8.47 |
-8.89 |
-1.27 |
0 |
|
|
373048 |
131309076 |
1 |
BrON2H7C11 |
ABC2D7E11 |
78.96 |
2.14 |
-9.8 |
-1.28 |
0 |
|
|
373049 |
131309085 |
1 |
OSN2C12H14 |
ABC2D12E14 |
8.63 |
3.72 |
-8.33 |
-0.28 |
0 |
|
|
373050 |
131309123 |
1 |
BrClNOH11C12 |
ABCDE11F12 |
-5.07 |
4.77 |
-10.27 |
-0.91 |
0 |
|
|
373051 |
131309132 |
1 |
SN3O3C9H9 |
AB3C3D9E9 |
-61.6 |
7.06 |
-9.69 |
-1.69 |
0 |
|
|
373052 |
131309151 |
1 |
FNOC12H12 |
ABCD12E12 |
-45.23 |
4.26 |
-9.28 |
-0.38 |
0 |
|
|
373053 |
131309177 |
1 |
ClNOF3C10H11 |
ABCD3E10F11 |
-192.83 |
4.06 |
-9.66 |
-0.64 |
0 |
|
|
373054 |
131309189 |
1 |
BrSO3H9C11 |
ABC3D9E11 |
-83.9 |
5.65 |
-8.96 |
-1.2 |
0 |
|
|
373055 |
131309203 |
1 |
ClNO4C10H10 |
ABC4D10E10 |
-151.59 |
7.92 |
-9.19 |
-0.7 |
0 |
|
|
373056 |
131309210 |
1 |
BrN2O3H7C10 |
AB2C3D7E10 |
-70.88 |
3.93 |
-9.54 |
-1.54 |
0 |
|
|
373057 |
131309229 |
1 |
FSN2C12H15 |
ABC2D12E15 |
-27.79 |
2.41 |
-9.17 |
-0.84 |
0 |
|
|
373058 |
131309257 |
1 |
SO3H10C11 |
AB3C10D11 |
-103.57 |
3.35 |
-8.78 |
-0.9 |
0 |
|
|
373059 |
131309265 |
1 |
NO3C11H15 |
AB3C11D15 |
-111.61 |
3.12 |
-9.0 |
-0.01 |
0 |
|
|
373060 |
131309276 |
1 |
BrNOH10C11 |
ABCD10E11 |
5.65 |
4.08 |
-9.18 |
-0.34 |
0 |
|
|
373061 |
131309282 |
1 |
SF3N3C9H12 |
AB3C3D9E12 |
-146.21 |
1.97 |
-8.8 |
-0.17 |
0 |
|
|
373062 |
131309286 |
1 |
BrF2O3H7C9 |
AB2C3D7E9 |
-186.35 |
1.97 |
-9.19 |
-0.73 |
0 |
|
|
373063 |
131309291 |
1 |
BrN2O2H9C10 |
AB2C2D9E10 |
-30.45 |
5.75 |
-10.22 |
-1.38 |
0 |
|
|
373064 |
131309346 |
1 |
BrNSO3H6C10 |
ABCD3E6F10 |
9.14 |
2.89 |
-9.77 |
-1.96 |
0 |
|
|
373065 |
131309369 |
1 |
SO2N3C6H13 |
AB2C3D6E13 |
-75.24 |
4.62 |
-9.32 |
-0.05 |
0 |
|
|
373066 |
131309377 |
1 |
SO3H10C11 |
AB3C10D11 |
-106.0 |
4.61 |
-9.0 |
-1.15 |
0 |
|
|
373067 |
131309380 |
1 |
SO3H10C11 |
AB3C10D11 |
-103.9 |
5.95 |
-9.03 |
-1.09 |
0 |
|
|
373068 |
131309383 |
4 |
NC3H3 |
AB3C3 |
90.11 |
1.69 |
-9.65 |
-0.65 |
0 |
|
|
373069 |
131309386 |
4 |
NC3H3 |
AB3C3 |
92.54 |
2.4 |
-8.66 |
-0.26 |
0 |
|
|
373070 |
131309418 |
1 |
BrNSO3H6C10 |
ABCD3E6F10 |
11.47 |
4.35 |
-9.48 |
-2.37 |
0 |
|
|
373071 |
131309428 |
1 |
SO4H8C10 |
AB4C8D10 |
-142.02 |
4.52 |
-8.98 |
-1.19 |
0 |
|
|
373072 |
131309429 |
1 |
SO4H8C10 |
AB4C8D10 |
-132.16 |
4.37 |
-8.72 |
-0.74 |
0 |
|
|
373073 |
131309463 |
1 |
ClSO3H7C10 |
ABC3D7E10 |
-104.3 |
5.65 |
-9.16 |
-1.2 |
0 |
|
|
373074 |
131309469 |
1 |
ClSO3H7C10 |
ABC3D7E10 |
-99.05 |
4.41 |
-9.1 |
-1.34 |
0 |
|
|
373075 |
131309480 |
1 |
NOCl2H9C11 |
ABC2D9E11 |
-19.51 |
6.4 |
-8.45 |
-0.42 |
0 |
|
|
373076 |
131309483 |
1 |
SN2C8H8 |
AB2C8D8 |
50.62 |
2.78 |
-7.99 |
-0.01 |
0 |
|
|
373077 |
131309503 |
1 |
NO4C9H9 |
AB4C9D9 |
-52.57 |
7.54 |
-9.69 |
-1.6 |
0 |
|
|
373078 |
131309515 |
1 |
FO2H7C9 |
AB2C7D9 |
-84.27 |
4.44 |
-10.01 |
-1.36 |
0 |
|
|
373079 |
131309519 |
1 |
IO2F3H8C10 |
AB2C3D8E10 |
-203.43 |
5.08 |
-9.86 |
-1.57 |
0 |
|
|
373080 |
131309536 |
1 |
SO3H10C11 |
AB3C10D11 |
-69.64 |
0.97 |
-8.68 |
-1.14 |
0 |
|
|
373081 |
131309560 |
1 |
N2C11H12 |
A2B11C12 |
40.67 |
3.71 |
-8.37 |
0.2 |
0 |
|
|
373082 |
131309595 |
1 |
BrSO3H9C11 |
ABC3D9E11 |
-90.26 |
1.5 |
-8.92 |
-1.11 |
0 |
|
|
373083 |
131309616 |
1 |
BrSO2C11H11 |
ABC2D11E11 |
-34.2 |
4.27 |
-8.08 |
-0.64 |
0 |
|
|
373084 |
131309617 |
1 |
BrSO2C11H11 |
ABC2D11E11 |
-38.6 |
3.92 |
-8.4 |
-0.44 |
0 |
|
|
373085 |
131309642 |
1 |
FSO2H9C11 |
ABC2D9E11 |
-75.78 |
6.28 |
-8.63 |
-1.13 |
0 |
|
|
373086 |
131309648 |
1 |
FSO2H9C11 |
ABC2D9E11 |
-74.27 |
1.14 |
-8.74 |
-1.2 |
0 |
|
|
373087 |
131309655 |
1 |
FSO2H9C11 |
ABC2D9E11 |
-79.37 |
2.66 |
-8.8 |
-1.06 |
0 |
|
|
373088 |
131309679 |
1 |
BrON2C11H11 |
ABC2D11E11 |
-3.39 |
2.86 |
-9.11 |
-0.55 |
0 |
|
|
373089 |
131309727 |
1 |
NOBr2H5C8 |
ABC2D5E8 |
11.47 |
4.49 |
-9.84 |
-1.0 |
0 |
|
|
373090 |
131309728 |
1 |
NOBr2H5C8 |
ABC2D5E8 |
9.36 |
4.44 |
-9.75 |
-0.98 |
0 |
|
|
373091 |
131309734 |
1 |
N2C9H16 |
A2B9C16 |
4.8 |
2.59 |
-9.2 |
1.31 |
0 |
|
|
373092 |
131309743 |
1 |
N2C9H16 |
A2B9C16 |
5.41 |
4.55 |
-9.0 |
1.36 |
0 |
|
|
373093 |
131309831 |
1 |
ClN4C11H19 |
AB4C11D19 |
30.44 |
5.05 |
-8.69 |
0.49 |
0 |
|
|
373094 |
131309861 |
1 |
N2O3H14C17 |
A2B3C14D17 |
-41.45 |
4.94 |
-9.19 |
-0.91 |
0 |
|
|
373095 |
131309890 |
1 |
ClN2O2F3H6C7 |
AB2C2D3E6F7 |
-218.7 |
4.17 |
-8.71 |
-0.74 |
0 |
|
|
373096 |
131309898 |
1 |
ClON2F3C8H8 |
ABC2D3E8F8 |
-194.62 |
1.53 |
-9.21 |
-0.99 |
0 |
|
|
373097 |
131309903 |
1 |
ClON2F3C8H8 |
ABC2D3E8F8 |
-201.48 |
4.82 |
-9.22 |
-0.48 |
0 |
|
|
373098 |
131309911 |
1 |
BrNF4C10H10 |
ABC4D10E10 |
-199.87 |
2.96 |
-9.76 |
-0.62 |
0 |
|
|
373099 |
131309936 |
1 |
N5H9C11 |
A5B9C11 |
102.5 |
5.05 |
-9.22 |
-1.36 |
0 |
|
|
373100 |
131309942 |
1 |
SN2O3C9H10 |
AB2C3D9E10 |
-103.26 |
2.91 |
-8.52 |
-1.19 |
0 |
|
|
373101 |
131309948 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-63.6 |
2.03 |
-9.27 |
-0.5 |
0 |
|
|
373102 |
131309951 |
1 |
ON2C10H10 |
AB2C10D10 |
24.67 |
2.52 |
-9.03 |
-0.38 |
0 |
|
|
373103 |
131309983 |
1 |
BrNOF2C8H8 |
ABCD2E8F8 |
-110.33 |
1.99 |
-9.85 |
-0.85 |
0 |
|
|
373104 |
131309985 |
1 |
SN2F3C5H5 |
AB2C3D5E5 |
-122.09 |
2.57 |
-9.87 |
-0.96 |
0 |
|
|
373105 |
131309996 |
1 |
OSCl2C11H12 |
ABC2D11E12 |
-42.55 |
2.56 |
-8.65 |
-0.88 |
0 |
|
|
373106 |
131310001 |
1 |
OSCl2C11H12 |
ABC2D11E12 |
-42.41 |
3.41 |
-8.89 |
-0.98 |
0 |
|
|
373107 |
131310011 |
1 |
OSN2C7H8 |
ABC2D7E8 |
7.42 |
3.5 |
-9.28 |
-1.33 |
0 |
|
|
373108 |
131310084 |
1 |
ON5C9H11 |
AB5C9D11 |
50.72 |
2.93 |
-9.06 |
-1.58 |
0 |
|
|
373109 |
131310106 |
1 |
ON2C11H14 |
AB2C11D14 |
-4.72 |
5.03 |
-9.86 |
-0.23 |
0 |
|
|
373110 |
131310120 |
1 |
ClIO2C11H14 |
ABC2D11E14 |
-68.2 |
5.03 |
-8.87 |
-0.7 |
0 |
|
|
373111 |
131310135 |
1 |
BrClO2C16H16 |
ABC2D16E16 |
-46.56 |
2.23 |
-9.09 |
-0.38 |
0 |
|
|
373112 |
131310146 |
1 |
BrClNOH11C12 |
ABCDE11F12 |
-17.77 |
4.33 |
-9.48 |
-0.95 |
0 |
|
|
373113 |
131310147 |
2 |
NOC6H8 |
ABC6D8 |
-80.51 |
4.63 |
-9.63 |
-0.42 |
0 |
|
|
373114 |
131310156 |
1 |
BrClNOH11C12 |
ABCDE11F12 |
-5.21 |
1.14 |
-10.28 |
-1.22 |
0 |
|
|
373115 |
131310158 |
1 |
BrClNOH11C12 |
ABCDE11F12 |
-5.08 |
2.75 |
-10.39 |
-1.21 |
0 |
|
|
373116 |
131310188 |
1 |
BrNOC13H18 |
ABCD13E18 |
-44.07 |
4.66 |
-9.17 |
-0.34 |
0 |