List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
364089 |
127313878 |
1 |
NOC14H27 |
ABC14D27 |
-76.91 |
1.58 |
-8.42 |
2.42 |
0 |
|
|
364090 |
127313879 |
1 |
SN3O3C14H27 |
AB3C3D14E27 |
-136.79 |
4.59 |
-8.69 |
0.0 |
0 |
|
|
364091 |
127313880 |
1 |
ON2C15H28 |
AB2C15D28 |
-66.51 |
2.18 |
-8.26 |
2.5 |
0 |
|
|
364092 |
127313881 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-50.19 |
4.19 |
-8.82 |
-0.41 |
0 |
|
|
364093 |
127313882 |
1 |
ClO2N4C20H27 |
AB2C4D20E27 |
-15.39 |
1.88 |
-8.7 |
-0.94 |
0 |
|
|
364094 |
127313883 |
1 |
SN3O4C16H31 |
AB3C4D16E31 |
-185.64 |
4.38 |
-8.81 |
-0.17 |
0 |
|
|
364095 |
127313884 |
1 |
SN3O3C17H33 |
AB3C3D17E33 |
-146.75 |
5.04 |
-8.67 |
0.0 |
0 |
|
|
364096 |
127314031 |
1 |
SN3O3C16H17 |
AB3C3D16E17 |
-60.17 |
7.29 |
-9.55 |
-0.58 |
0 |
|
|
364097 |
127314032 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-29.39 |
7.69 |
-9.67 |
-0.54 |
0 |
|
|
364098 |
127314033 |
1 |
SO3N4C12H14 |
AB3C4D12E14 |
-39.12 |
4.02 |
-9.88 |
-0.59 |
0 |
|
|
364099 |
127314034 |
1 |
SO3N4C17H18 |
AB3C4D17E18 |
-56.75 |
10.42 |
-9.37 |
-0.79 |
0 |
|
|
364100 |
127314035 |
1 |
SO2N4C13H20 |
AB2C4D13E20 |
-53.35 |
5.19 |
-9.77 |
-0.54 |
0 |
|
|
364101 |
127314036 |
1 |
SO3N5C16H17 |
AB3C5D16E17 |
-44.24 |
5.15 |
-9.2 |
-0.97 |
0 |
|
|
364102 |
127314048 |
1 |
SN3O3C13H19 |
AB3C3D13E19 |
-97.08 |
3.62 |
-9.93 |
-0.58 |
0 |
|
|
364103 |
127314049 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-76.1 |
8.75 |
-9.65 |
-0.5 |
0 |
|
|
364104 |
127314050 |
1 |
SO2N6C15H16 |
AB2C6D15E16 |
26.79 |
5.68 |
-9.6 |
-1.02 |
0 |
|
|
364105 |
127314051 |
1 |
SO2N3C14H21 |
AB2C3D14E21 |
-64.5 |
4.26 |
-9.85 |
-0.56 |
0 |
|
|
364106 |
127314052 |
1 |
SN3O4C15H15 |
AB3C4D15E15 |
-85.22 |
5.6 |
-9.26 |
-0.8 |
0 |
|
|
364107 |
127314053 |
1 |
SO3N4C18H20 |
AB3C4D18E20 |
-68.31 |
9.43 |
-9.32 |
-0.72 |
0 |
|
|
364108 |
127314054 |
1 |
SO2N4C13H20 |
AB2C4D13E20 |
-53.24 |
5.1 |
-9.79 |
-0.55 |
0 |
|
|
364109 |
127314055 |
2 |
SN2O2C8H9 |
AB2C2D8E9 |
-63.75 |
1.9 |
-10.05 |
-1.46 |
0 |
|
|
364110 |
127314056 |
2 |
SN2O2C8H9 |
AB2C2D8E9 |
-95.94 |
12.05 |
-9.36 |
-0.47 |
0 |
|
|
364111 |
127314057 |
1 |
SN3O4C15H15 |
AB3C4D15E15 |
-82.14 |
7.89 |
-9.39 |
-0.8 |
0 |
|
|
364112 |
127314058 |
1 |
SO2N4C13H20 |
AB2C4D13E20 |
-48.4 |
5.71 |
-9.73 |
-0.56 |
0 |
|
|
364113 |
127314059 |
1 |
SN4O4C18H20 |
AB4C4D18E20 |
-88.26 |
4.48 |
-9.71 |
-1.19 |
0 |
|
|
364114 |
127314060 |
1 |
FSO3N4H15C16 |
ABC3D4E15F16 |
-113.95 |
6.07 |
-9.76 |
-1.19 |
0 |
|
|
364115 |
127314061 |
1 |
SO2N3C16H17 |
AB2C3D16E17 |
-19.88 |
6.8 |
-9.4 |
-0.55 |
0 |
|
|
364116 |
127314062 |
1 |
SN3O3C17H23 |
AB3C3D17E23 |
-91.29 |
3.04 |
-9.9 |
-0.56 |
0 |
|
|
364117 |
127314256 |
1 |
ON5C16H25 |
AB5C16D25 |
-19.16 |
7.04 |
-9.06 |
-0.46 |
0 |
|
|
364118 |
127314257 |
1 |
O2N3C14H27 |
A2B3C14D27 |
-94.19 |
5.03 |
-8.96 |
1.23 |
0 |
|
|
364119 |
127314258 |
1 |
N3O3C13H23 |
A3B3C13D23 |
-136.95 |
3.03 |
-9.52 |
0.69 |
0 |
|
|
364120 |
127314259 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-74.23 |
3.6 |
-9.68 |
-0.54 |
0 |
|
|
364121 |
127314260 |
1 |
N2O3C15H28 |
A2B3C15D28 |
-147.73 |
4.88 |
-9.71 |
1.13 |
0 |
|
|
364122 |
127314261 |
2 |
ON3C8H13 |
AB3C8D13 |
-34.2 |
3.41 |
-8.68 |
-0.03 |
0 |
|
|
364123 |
127314262 |
1 |
ON4C16H24 |
AB4C16D24 |
-32.57 |
6.32 |
-9.67 |
-0.52 |
0 |
|
|
364124 |
127314297 |
1 |
O2N5C14H17 |
A2B5C14D17 |
-1.44 |
5.16 |
-9.78 |
-0.56 |
0 |
|
|
364125 |
127314298 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-77.75 |
4.74 |
-9.94 |
0.03 |
0 |
|
|
364126 |
127314299 |
1 |
OSN4C14H16 |
ABC4D14E16 |
13.95 |
4.56 |
-9.11 |
-0.6 |
0 |
|
|
364127 |
127314300 |
1 |
FON4C17H17 |
ABC4D17E17 |
-10.44 |
5.4 |
-9.61 |
-0.66 |
0 |
|
|
364128 |
127314301 |
1 |
OF3N5C15H20 |
AB3C5D15E20 |
-175.23 |
4.38 |
-9.54 |
-0.61 |
0 |
|
|
364129 |
127314302 |
1 |
ON5C19H29 |
AB5C19D29 |
-30.49 |
4.88 |
-8.89 |
-0.56 |
0 |
|
|
364130 |
127314303 |
1 |
O2N5C14H19 |
A2B5C14D19 |
-55.24 |
5.29 |
-9.77 |
-0.91 |
0 |
|
|
364131 |
127314304 |
3 |
NOC4H7 |
ABC4D7 |
-122.6 |
2.09 |
-9.52 |
0.38 |
0 |
|
|
364132 |
127314305 |
2 |
ON3C9H15 |
AB3C9D15 |
-50.5 |
4.5 |
-8.93 |
0.42 |
0 |
|
|
364133 |
127314306 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-79.18 |
3.4 |
-8.42 |
0.14 |
0 |
|
|
364134 |
127314307 |
1 |
OSN5C13H15 |
ABC5D13E15 |
22.69 |
0.94 |
-9.67 |
-0.78 |
0 |
|
|
364135 |
127314308 |
1 |
N2O4C17H24 |
A2B4C17D24 |
-135.61 |
2.26 |
-8.73 |
-0.04 |
0 |
|
|
364136 |
127314309 |
1 |
SO3N5C13H19 |
AB3C5D13E19 |
-87.06 |
8.16 |
-9.63 |
-0.44 |
0 |
|
|
364137 |
127314310 |
1 |
SN3O4C11H21 |
AB3C4D11E21 |
-162.05 |
5.46 |
-9.67 |
0.19 |
0 |
|
|
364138 |
127314311 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-66.01 |
5.44 |
-9.3 |
-0.68 |
0 |