List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
393188 |
135019651 |
1 |
NO3H19C22 |
AB3C19D22 |
-62.46 |
3.49 |
-8.49 |
-0.55 |
0 |
|
|
393189 |
135019653 |
1 |
SN3O12H15C19 |
AB3C12D15E19 |
-191.72 |
4.91 |
-11.01 |
-3.15 |
0 |
|
|
393190 |
135019675 |
1 |
NO2C23H25 |
AB2C23D25 |
32.44 |
1.85 |
-9.02 |
0.22 |
0 |
|
|
393191 |
135019678 |
1 |
NOS2C15H17 |
ABC2D15E17 |
11.28 |
7.05 |
-8.42 |
-0.76 |
0 |
|
|
393192 |
135019686 |
1 |
NO4C23H23 |
AB4C23D23 |
-74.31 |
3.96 |
-8.38 |
-0.52 |
0 |
|
|
393193 |
135019689 |
1 |
ClNO4C17H18 |
ABC4D17E18 |
-66.15 |
8.02 |
-8.9 |
-1.26 |
0 |
|
|
393194 |
135019691 |
1 |
O3C8H10 |
A3B8C10 |
-111.69 |
1.76 |
-9.15 |
-0.17 |
0 |
|
|
393195 |
135019696 |
1 |
SiO2C18H32 |
AB2C18D32 |
-168.87 |
3.78 |
-8.58 |
0.78 |
0 |
|
|
393196 |
135019697 |
1 |
NO2I3C26H34 |
AB2C3D26E34 |
-53.01 |
3.71 |
-8.77 |
-1.71 |
0 |
|
|
393198 |
135019701 |
1 |
N2O7C26H36 |
A2B7C26D36 |
-290.56 |
5.52 |
-8.89 |
0.02 |
0 |
|
|
393199 |
135019702 |
1 |
OSH22C23 |
ABC22D23 |
135.86 |
4.07 |
-8.54 |
-0.29 |
0 |
|
|
393200 |
135019703 |
2 |
O3C13H22 |
A3B13C22 |
-329.65 |
4.59 |
-10.43 |
-0.64 |
0 |
|
|
393201 |
135019704 |
1 |
ClNSO2H20C22 |
ABCD2E20F22 |
-23.82 |
7.39 |
-8.96 |
-0.56 |
0 |
|
|
393202 |
135019705 |
1 |
O2C19H20 |
A2B19C20 |
-55.93 |
1.94 |
-9.11 |
-0.14 |
0 |
|
|
393203 |
135019726 |
1 |
O3N5H21C22 |
A3B5C21D22 |
-36.77 |
2.74 |
-8.77 |
-0.76 |
0 |
|
|
393204 |
135019727 |
1 |
ON5C15H17 |
AB5C15D17 |
23.22 |
3.82 |
-8.73 |
-0.77 |
0 |
|
|
393205 |
135019728 |
2 |
O2N3C14H15 |
A2B3C14D15 |
-87.11 |
1.83 |
-8.94 |
-0.74 |
0 |
|
|
393206 |
135019731 |
1 |
N2C21H24 |
A2B21C24 |
89.07 |
4.52 |
-9.16 |
-0.03 |
0 |
|
|
393207 |
135019740 |
1 |
O6C17H20 |
A6B17C20 |
-229.5 |
6.26 |
-8.9 |
-1.08 |
0 |
|
|
393208 |
135019745 |
1 |
NSiO3C44H51 |
ABC3D44E51 |
-96.17 |
2.18 |
-8.67 |
-1.13 |
0 |
|
|
393209 |
135019747 |
1 |
NO14H55C67 |
AB14C55D67 |
-251.37 |
13.04 |
-8.31 |
-2.06 |
-4 |
|
|
393210 |
135019749 |
1 |
PdN2F4C7H8 |
AB2C4D7E8 |
-114.88 |
10.23 |
-8.51 |
-0.9 |
1 |
|
|
393211 |
135019750 |
1 |
O2N3C5H10 |
A2B3C5D10 |
-27.29 |
3.94 |
0.0 |
0.0 |
0 |
|
|
393214 |
135019756 |
1 |
NO6C25H35 |
AB6C25D35 |
-228.09 |
2.54 |
-8.33 |
-0.19 |
0 |
|
|
393215 |
135019757 |
1 |
NO8C31H41 |
AB8C31D41 |
-349.08 |
4.37 |
-8.74 |
-0.06 |
0 |
|
|
393216 |
135019758 |
1 |
NSi3O6C43H75 |
AB3C6D43E75 |
-406.87 |
3.11 |
-8.2 |
0.29 |
0 |
|
|
393217 |
135019761 |
1 |
NSiO4C22H33 |
ABC4D22E33 |
-219.65 |
5.91 |
-8.97 |
-0.77 |
0 |
|
|
393218 |
135019762 |
1 |
NSiO4C22H35 |
ABC4D22E35 |
-247.58 |
1.45 |
-8.71 |
0.0 |
0 |
|
|
393219 |
135019763 |
1 |
NSiO2C18H29 |
ABC2D18E29 |
-140.03 |
3.95 |
-8.95 |
-0.07 |
0 |
|
|
393220 |
135019767 |
1 |
N4O9C36H54 |
A4B9C36D54 |
-391.18 |
6.12 |
-8.02 |
-0.16 |
0 |
|
|
393221 |
135019769 |
1 |
SN7O11C29H39 |
AB7C11D29E39 |
-370.52 |
15.01 |
-9.25 |
-1.19 |
0 |
|
|
393222 |
135019771 |
1 |
IN2O3H25C27 |
AB2C3D25E27 |
-1.36 |
5.73 |
-8.4 |
-1.05 |
0 |
|
|
393223 |
135019774 |
1 |
N2H22C23 |
A2B22C23 |
86.74 |
3.0 |
-8.65 |
-0.37 |
0 |
|
|
393224 |
135019775 |
1 |
NO4H17C20 |
AB4C17D20 |
-105.72 |
1.16 |
-10.12 |
-1.87 |
0 |
|
|
393225 |
135019776 |
1 |
SF3O4H21C27 |
AB3C4D21E27 |
-253.62 |
2.71 |
-9.12 |
-1.76 |
0 |
|
|
393226 |
135019778 |
1 |
NO15C22H33 |
AB15C22D33 |
-660.37 |
3.91 |
-10.22 |
-0.2 |
0 |
|
|
393227 |
135019780 |
1 |
NH33C60 |
AB33C60 |
686.51 |
23.06 |
-6.28 |
-2.3 |
0 |
|
|
393228 |
135019781 |
1 |
SiO2C28H36 |
AB2C28D36 |
-61.4 |
2.86 |
-9.06 |
-0.06 |
0 |
|
|
393229 |
135019782 |
1 |
Si2O3C38H60 |
A2B3C38D60 |
-243.43 |
1.96 |
-8.67 |
0.02 |
0 |
|
|
393230 |
135019783 |
1 |
SSiN2O6C31H52 |
ABC2D6E31F52 |
-251.63 |
6.22 |
-8.88 |
-1.73 |
1 |
|
|
393231 |
135019785 |
1 |
OCl2N2C5H5 |
AB2C2D5E5 |
-12.59 |
4.95 |
0.0 |
0.0 |
1 |
|
|
393232 |
135019786 |
1 |
O2H9C10 |
A2B9C10 |
-3.26 |
1.39 |
0.0 |
0.0 |
0 |
|
|
393233 |
135019787 |
1 |
BrNO3C19H20 |
ABC3D19E20 |
-113.47 |
2.01 |
-8.69 |
-0.89 |
0 |
|
|
393234 |
135019791 |
1 |
NSO6C27H29 |
ABC6D27E29 |
-176.47 |
4.31 |
-8.84 |
-0.38 |
0 |
|
|
393235 |
135019792 |
1 |
NSO6C26H27 |
ABC6D26E27 |
-163.38 |
6.16 |
-9.06 |
-0.59 |
0 |
|
|
393236 |
135019793 |
1 |
BrNSO6C26H26 |
ABCD6E26F26 |
-159.49 |
6.61 |
-9.14 |
-0.71 |
0 |
|
|
393237 |
135019820 |
2 |
O2H13C14 |
A2B13C14 |
-15.26 |
5.75 |
-8.8 |
-0.77 |
0 |
|
|
393238 |
135019827 |
2 |
OC9H10 |
AB9C10 |
-59.91 |
1.48 |
-9.18 |
-0.07 |
0 |
|
|
393239 |
135019833 |
2 |
NO4C9H14 |
AB4C9D14 |
-356.83 |
1.68 |
-9.7 |
-0.77 |
0 |
|
|
393240 |
135019838 |
1 |
OSC12H18 |
ABC12D18 |
-33.79 |
3.01 |
-9.27 |
-0.32 |
0 |
|
|
393241 |
135019842 |
1 |
SO3C36H74 |
AB3C36D74 |
-305.54 |
3.59 |
-10.62 |
0.27 |
0 |
|
|
393242 |
135019850 |
1 |
INO4C16H18 |
ABC4D16E18 |
-141.18 |
3.82 |
-9.31 |
-1.63 |
0 |
|
|
393243 |
135019854 |
1 |
BrNO2C16H18 |
ABC2D16E18 |
-35.7 |
6.09 |
-8.14 |
-0.06 |
0 |
|
|
393244 |
135019855 |
1 |
O5C26H40 |
A5B26C40 |
-232.7 |
4.42 |
-9.16 |
-0.04 |
0 |
|
|
393245 |
135019856 |
1 |
NO4C14H23 |
AB4C14D23 |
-187.76 |
0.84 |
-9.3 |
0.77 |
0 |
|
|
393246 |
135019877 |
1 |
ION2C28H29 |
ABC2D28E29 |
67.16 |
3.87 |
-9.17 |
-1.27 |
0 |
|
|
393247 |
135019880 |
1 |
ION2H21C25 |
ABC2D21E25 |
94.64 |
3.64 |
-9.06 |
-1.22 |
0 |
|
|
393248 |
135019881 |
1 |
IN2O3H25C27 |
AB2C3D25E27 |
17.79 |
2.67 |
-8.42 |
-1.24 |
0 |
|
|
393249 |
135019882 |
1 |
ION2H21C25 |
ABC2D21E25 |
81.64 |
2.58 |
-8.61 |
-1.18 |
0 |
|
|
393250 |
135019883 |
1 |
ION2C27H27 |
ABC2D27E27 |
74.89 |
4.79 |
-8.98 |
-1.19 |
0 |
|
|
393251 |
135019884 |
1 |
IN2O2H29C32 |
AB2C2D29E32 |
66.72 |
5.42 |
-8.84 |
-1.15 |
0 |
|
|
393252 |
135019885 |
1 |
IO2N3H26C32 |
AB2C3D26E32 |
101.11 |
6.49 |
-8.8 |
-1.35 |
0 |
|
|
393253 |
135019888 |
1 |
O11C13H24 |
A11B13C24 |
-496.79 |
5.48 |
-10.53 |
0.61 |
0 |
|
|
393254 |
135019889 |
1 |
S2F3O3C18H25 |
A2B3C3D18E25 |
-314.81 |
1.97 |
-9.04 |
-1.16 |
0 |
|
|
393255 |
135019894 |
1 |
O2N3C18H29 |
A2B3C18D29 |
44.57 |
8.26 |
-8.52 |
0.33 |
0 |
|
|
393256 |
135019895 |
2 |
O3C6N8 |
A3B6C8 |
489.33 |
0.54 |
-10.95 |
-2.71 |
0 |
|
|
393257 |
135019896 |
1 |
Si2O4C31H42 |
A2B4C31D42 |
-226.43 |
4.07 |
-8.83 |
-0.42 |
0 |
|
|
393259 |
135019899 |
1 |
NSiO4C30H53 |
ABC4D30E53 |
-276.8 |
4.21 |
-8.94 |
0.01 |
0 |
|
|
393260 |
135019900 |
1 |
NO4C21H31 |
AB4C21D31 |
-198.37 |
4.33 |
-9.31 |
-0.4 |
0 |
|
|
393261 |
135019903 |
1 |
NOH17C19 |
ABC17D19 |
21.48 |
4.9 |
-8.61 |
-0.6 |
0 |
|
|
393262 |
135019905 |
1 |
NSO6C30H41 |
ABC6D30E41 |
-224.58 |
4.88 |
-9.04 |
-0.6 |
0 |
|
|
393263 |
135019906 |
2 |
NC11H12 |
AB11C12 |
72.87 |
0.71 |
-7.85 |
0.28 |
0 |
|
|
393264 |
135019907 |
2 |
OC6H11 |
AB6C11 |
-129.32 |
2.1 |
-9.4 |
0.56 |
0 |
|
|
393265 |
135019909 |
2 |
N2O5H40C49 |
A2B5C40D49 |
-133.58 |
8.25 |
-8.47 |
-1.57 |
0 |
|
|
393266 |
135019910 |
6 |
NO2H16C20 |
AB2C16D20 |
-123.0 |
13.33 |
-8.61 |
-1.72 |
0 |