List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
420078 |
135111025 |
1 |
O2S2N3C21H27 |
A2B2C3D21E27 |
-22.55 |
3.2 |
-8.81 |
-0.89 |
0 |
|
|
420080 |
135111032 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-60.53 |
3.29 |
-9.75 |
-1.18 |
0 |
|
|
420081 |
135111049 |
1 |
N2O3C22H32 |
A2B3C22D32 |
-159.95 |
5.6 |
-8.74 |
0.01 |
0 |
|
|
420082 |
135111054 |
1 |
N2O3C24H34 |
A2B3C24D34 |
-137.66 |
8.35 |
-9.05 |
0.11 |
0 |
|
|
420083 |
135111055 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-77.22 |
3.65 |
-8.64 |
0.25 |
0 |
|
|
420084 |
135111062 |
1 |
ClFON4C17H22 |
ABCD4E17F22 |
-59.01 |
5.09 |
-8.83 |
-0.23 |
0 |
|
|
420085 |
135111071 |
1 |
ON4C16H28 |
AB4C16D28 |
-46.96 |
4.23 |
-8.66 |
0.88 |
0 |
|
|
420086 |
135111073 |
1 |
N7C14H23 |
A7B14C23 |
58.82 |
5.77 |
-8.72 |
0.19 |
0 |
|
|
420087 |
135111089 |
1 |
NNa2O4C14H17 |
AB2C4D14E17 |
-251.56 |
4.07 |
-7.58 |
0.31 |
0 |
|
|
420088 |
135111091 |
1 |
NO6C24H29 |
AB6C24D29 |
-201.66 |
6.29 |
-8.34 |
-0.11 |
0 |
|
|
420089 |
135111093 |
1 |
SO3N4C16H24 |
AB3C4D16E24 |
-112.6 |
10.55 |
-9.46 |
-0.69 |
0 |
|
|
420090 |
135111094 |
1 |
N2O4C21H32 |
A2B4C21D32 |
-161.64 |
4.42 |
-8.99 |
-0.32 |
0 |
|
|
420092 |
135111110 |
1 |
N5C19H25 |
A5B19C25 |
45.21 |
2.77 |
-8.58 |
-0.26 |
0 |
|
|
420093 |
135111111 |
1 |
FO2N4C19H23 |
AB2C4D19E23 |
-70.13 |
7.67 |
-9.05 |
-0.84 |
0 |
|
|
420095 |
135111116 |
1 |
N7O8C40H49 |
A7B8C40D49 |
-252.43 |
8.4 |
-8.23 |
-0.66 |
0 |
|
|
420096 |
135111117 |
1 |
O2N5C24H25 |
A2B5C24D25 |
2.64 |
2.86 |
-9.37 |
-0.97 |
0 |
|
|
420097 |
135111118 |
1 |
N2O3C21H28 |
A2B3C21D28 |
-114.83 |
2.44 |
-8.98 |
-0.54 |
0 |
|
|
420098 |
135111120 |
1 |
N2O3C22H30 |
A2B3C22D30 |
-110.61 |
7.48 |
-9.17 |
0.25 |
0 |
|
|
420099 |
135111138 |
1 |
NO3C14H19 |
AB3C14D19 |
-127.09 |
5.8 |
-9.22 |
0.13 |
0 |
|
|
420100 |
135111142 |
1 |
ClO3N4C18H19 |
AB3C4D18E19 |
-54.06 |
3.66 |
-9.48 |
-0.66 |
0 |
|
|
420101 |
135111147 |
1 |
O5N7C28H39 |
A5B7C28D39 |
-174.08 |
5.45 |
-9.4 |
-0.54 |
0 |
|
|
420102 |
135111156 |
1 |
SN4O4C17H22 |
AB4C4D17E22 |
-123.31 |
3.98 |
-9.5 |
-0.67 |
0 |
|
|
420103 |
135111157 |
1 |
ON5C23H25 |
AB5C23D25 |
27.38 |
7.68 |
-8.1 |
-0.7 |
0 |
|
|
420104 |
135111158 |
2 |
NOF2C9H11 |
ABC2D9E11 |
-291.18 |
6.02 |
-9.2 |
-0.82 |
0 |
|
|
420105 |
135111160 |
1 |
O4N5C25H33 |
A4B5C25D33 |
-103.68 |
3.5 |
-8.9 |
-0.31 |
0 |
|
|
420106 |
135111161 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-117.31 |
6.53 |
-9.54 |
-0.66 |
0 |
|
|
420107 |
135111162 |
1 |
ON5C20H29 |
AB5C20D29 |
2.88 |
1.58 |
-8.09 |
0.32 |
0 |
|
|
420108 |
135111170 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-80.4 |
5.35 |
-9.02 |
0.19 |
0 |
|
|
420109 |
135111193 |
1 |
ClON2C20H25 |
ABC2D20E25 |
-41.86 |
6.74 |
-8.1 |
-0.37 |
0 |
|
|
420110 |
135111196 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-84.42 |
4.48 |
-8.97 |
-0.21 |
0 |
|
|
420111 |
135111199 |
1 |
N2O2C23H32 |
A2B2C23D32 |
-61.07 |
1.67 |
-8.74 |
-0.54 |
0 |
|
|
420112 |
135111213 |
1 |
NO5C21H31 |
AB5C21D31 |
-224.75 |
4.05 |
-9.12 |
-0.12 |
0 |
|
|
420113 |
135111218 |
1 |
SO2N4C16H22 |
AB2C4D16E22 |
-11.14 |
3.71 |
-9.08 |
-0.65 |
0 |
|
|
420114 |
135111222 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-12.99 |
5.39 |
-8.46 |
-0.06 |
0 |
|
|
420115 |
135111237 |
1 |
SO3N10C34H46 |
AB3C10D34E46 |
2.25 |
5.28 |
-7.53 |
-1.13 |
0 |
|
|
420116 |
135111247 |
2 |
N3O3C14H20 |
A3B3C14D20 |
-260.5 |
5.39 |
-9.61 |
0.06 |
0 |
|
|
420117 |
135111250 |
1 |
N2O4C19H22 |
A2B4C19D22 |
-142.52 |
6.21 |
-9.04 |
-0.69 |
0 |
|
|
420118 |
135111251 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-77.98 |
7.64 |
-9.34 |
-0.68 |
0 |
|
|
420119 |
135111252 |
1 |
N2O3C18H26 |
A2B3C18D26 |
-121.44 |
4.96 |
-8.15 |
0.24 |
0 |
|
|
420120 |
135111253 |
1 |
FON3C17H20 |
ABC3D17E20 |
-39.44 |
2.21 |
-9.11 |
-0.89 |
0 |
|
|
420121 |
135111254 |
1 |
SN2O2F4H14C16 |
AB2C2D4E14F16 |
-231.1 |
5.84 |
-8.94 |
-0.89 |
0 |
|
|
420122 |
135111295 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-136.3 |
3.68 |
-8.47 |
0.01 |
0 |
|
|
420123 |
135111297 |
1 |
N7O7C39H53 |
A7B7C39D53 |
-169.75 |
4.5 |
-8.68 |
-0.41 |
0 |
|
|
420124 |
135111298 |
1 |
O3N4C17H20 |
A3B4C17D20 |
-60.35 |
5.87 |
-9.77 |
-0.34 |
0 |
|
|
420125 |
135111299 |
1 |
SF2N2O3C16H22 |
AB2C2D3E16F22 |
-199.58 |
2.6 |
-8.92 |
-1.16 |
0 |
|
|
420126 |
135111300 |
1 |
ON4C13H20 |
AB4C13D20 |
-13.41 |
2.66 |
-8.96 |
-0.07 |
0 |
|
|
420127 |
135111316 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-130.01 |
3.46 |
-8.87 |
0.42 |
0 |
|
|
420128 |
135111318 |
1 |
FN6O7C38H43 |
AB6C7D38E43 |
-228.17 |
3.78 |
-9.08 |
-1.86 |
0 |
|
|
420129 |
135111329 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-118.12 |
3.99 |
-8.11 |
-0.02 |
0 |
|
|
420130 |
135111332 |
1 |
FN2O4C16H19 |
AB2C4D16E19 |
-146.98 |
4.82 |
-9.32 |
-1.33 |
0 |