List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
283200 |
103963921 |
1 |
SN4C16H16 |
AB4C16D16 |
67.58 |
5.88 |
-8.46 |
-0.76 |
0 |
|
|
283201 |
103963944 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-27.8 |
7.36 |
-9.35 |
-1.47 |
0 |
|
|
283202 |
103963945 |
1 |
O2N3C14H17 |
A2B3C14D17 |
14.05 |
8.02 |
-9.21 |
-1.3 |
0 |
|
|
283203 |
103964037 |
1 |
O3N4H12C14 |
A3B4C12D14 |
57.12 |
5.27 |
-9.43 |
-1.55 |
0 |
|
|
283204 |
103964039 |
1 |
O2N3C14H15 |
A2B3C14D15 |
46.66 |
7.1 |
-9.14 |
-1.24 |
0 |
|
|
283205 |
103964042 |
1 |
SO2N3H13C15 |
AB2C3D13E15 |
58.79 |
8.07 |
-9.21 |
-1.32 |
0 |
|
|
283206 |
103964128 |
1 |
O3N4H10C13 |
A3B4C10D13 |
67.94 |
6.27 |
-9.35 |
-1.36 |
0 |
|
|
283207 |
103964225 |
1 |
SN3C17H21 |
AB3C17D21 |
36.78 |
3.97 |
-8.35 |
-1.14 |
0 |
|
|
283208 |
103964319 |
1 |
S2N3H9C14 |
A2B3C9D14 |
109.74 |
3.68 |
-8.42 |
-1.18 |
0 |
|
|
283209 |
103964403 |
1 |
ON4C14H16 |
AB4C14D16 |
26.77 |
7.28 |
-8.48 |
-0.5 |
0 |
|
|
283210 |
103964404 |
1 |
N4C17H20 |
A4B17C20 |
55.48 |
5.56 |
-8.92 |
-0.52 |
0 |
|
|
283211 |
103964475 |
1 |
ON4C15H18 |
AB4C15D18 |
24.11 |
5.14 |
-8.86 |
-0.58 |
0 |
|
|
283212 |
103964848 |
1 |
N3O3C13H13 |
A3B3C13D13 |
-0.37 |
6.14 |
-9.55 |
-1.71 |
0 |
|
|
283213 |
103964849 |
1 |
N3O3C13H13 |
A3B3C13D13 |
7.1 |
8.4 |
-9.07 |
-1.15 |
0 |
|
|
283214 |
103964901 |
1 |
O2N5H7C13 |
A2B5C7D13 |
132.4 |
5.82 |
-10.25 |
-2.37 |
0 |
|
|
283215 |
103964962 |
1 |
ON3C14H15 |
AB3C14D15 |
4.45 |
2.83 |
-8.74 |
-0.93 |
0 |
|
|
283216 |
103964972 |
1 |
O2N3H13C14 |
A2B3C13D14 |
-23.85 |
4.88 |
-8.61 |
-0.9 |
0 |
|
|
283217 |
103964997 |
1 |
ON3C15H15 |
AB3C15D15 |
16.36 |
4.99 |
-8.48 |
-0.78 |
0 |
|
|
283218 |
103965138 |
1 |
ClON2C17H25 |
ABC2D17E25 |
-81.64 |
2.35 |
-8.88 |
-0.38 |
0 |
|
|
283219 |
103965167 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-137.57 |
5.05 |
-8.73 |
0.04 |
0 |
|
|
283220 |
103965218 |
2 |
NOSC7H12 |
ABCD7E12 |
-91.3 |
5.02 |
-8.62 |
-0.86 |
0 |
|
|
283221 |
103965402 |
1 |
ON3C17H23 |
AB3C17D23 |
-16.98 |
4.79 |
-7.94 |
-0.58 |
0 |
|
|
283222 |
103965630 |
1 |
NOC19H31 |
ABC19D31 |
-65.42 |
1.22 |
-8.83 |
0.4 |
0 |
|
|
283223 |
103965714 |
1 |
N2C19H36 |
A2B19C36 |
-65.21 |
2.79 |
-8.73 |
2.96 |
0 |
|
|
283224 |
103965754 |
1 |
FNC19H30 |
ABC19D30 |
-77.06 |
3.01 |
-8.79 |
0.05 |
0 |
|
|
283225 |
103965803 |
1 |
NOSC13H25 |
ABCD13E25 |
-83.94 |
4.87 |
-8.47 |
0.7 |
0 |
|
|
283226 |
103965880 |
1 |
NOC17H29 |
ABC17D29 |
-53.3 |
3.64 |
-9.0 |
1.3 |
0 |
|
|
283227 |
103965932 |
1 |
ON2C13H26 |
AB2C13D26 |
-80.97 |
3.58 |
-8.96 |
2.7 |
0 |
|
|
283228 |
103965945 |
1 |
FNOCl2C16H22 |
ABCD2E16F22 |
-116.15 |
3.85 |
-9.27 |
-0.7 |
0 |
|
|
283229 |
103966011 |
1 |
ON2C17H34 |
AB2C17D34 |
-99.98 |
2.62 |
-8.7 |
2.89 |
0 |
|
|
283230 |
103966030 |
1 |
ClNO2C16H22 |
ABC2D16E22 |
-105.62 |
2.79 |
-9.65 |
-0.38 |
0 |
|
|
283231 |
103966377 |
1 |
N2O3C15H30 |
A2B3C15D30 |
-160.89 |
3.52 |
-8.83 |
2.03 |
0 |
|
|
283232 |
103966593 |
1 |
ON2C16H30 |
AB2C16D30 |
-81.3 |
2.83 |
-9.04 |
1.26 |
0 |
|
|
283233 |
103966596 |
1 |
ON2C15H28 |
AB2C15D28 |
-98.11 |
3.15 |
-9.39 |
1.5 |
0 |
|
|
283234 |
103966597 |
1 |
ON2C16H32 |
AB2C16D32 |
-106.25 |
3.6 |
-9.04 |
1.34 |
0 |
|
|
283235 |
103966640 |
2 |
NOC8H15 |
ABC8D15 |
-136.68 |
3.0 |
-9.45 |
1.07 |
0 |
|
|
283236 |
103966743 |
2 |
NOC7H14 |
ABC7D14 |
-142.19 |
5.18 |
-9.62 |
0.77 |
0 |
|
|
283237 |
103966797 |
1 |
ON2C18H30 |
AB2C18D30 |
-82.15 |
2.99 |
-9.87 |
0.77 |
0 |
|
|
283238 |
103966798 |
1 |
ON2C15H24 |
AB2C15D24 |
-43.97 |
3.12 |
-10.01 |
0.44 |
0 |
|
|
283239 |
103966838 |
2 |
NC9H13 |
AB9C13 |
-4.44 |
5.17 |
-8.49 |
-0.12 |
0 |
|
|
283240 |
103966995 |
1 |
ClNO2C17H24 |
ABC2D17E24 |
-125.75 |
3.62 |
-9.1 |
-0.8 |
0 |
|
|
283241 |
103967002 |
1 |
NO2C18H27 |
AB2C18D27 |
-121.07 |
5.37 |
-9.23 |
-0.23 |
0 |
|
|
283242 |
103967004 |
1 |
ClNO2C17H24 |
ABC2D17E24 |
-127.06 |
5.25 |
-9.41 |
-0.79 |
0 |
|
|
283243 |
103967036 |
1 |
ClNO3C15H20 |
ABC3D15E20 |
-140.85 |
5.72 |
-8.9 |
-0.75 |
0 |
|
|
283244 |
103967091 |
1 |
N3C17H27 |
A3B17C27 |
-17.39 |
4.15 |
-8.78 |
0.07 |
0 |
|
|
283245 |
103967135 |
1 |
SN3C14H25 |
AB3C14D25 |
-12.71 |
4.74 |
-8.88 |
-0.26 |
0 |
|
|
283246 |
103967506 |
1 |
FN3C17H24 |
AB3C17D24 |
-43.41 |
4.49 |
-8.76 |
-0.28 |
0 |
|
|
283247 |
103967545 |
1 |
SN2C12H20 |
AB2C12D20 |
10.6 |
1.98 |
-8.89 |
0.19 |
0 |
|
|
283248 |
103967546 |
1 |
SN2C13H24 |
AB2C13D24 |
-24.97 |
1.35 |
-8.82 |
0.3 |
0 |
|
|
283249 |
103967800 |
1 |
SN2C18H24 |
AB2C18D24 |
36.12 |
2.04 |
-8.94 |
0.18 |
0 |
|
|
283250 |
103967941 |
1 |
SN2C16H30 |
AB2C16D30 |
-36.9 |
1.51 |
-8.63 |
0.35 |
0 |
|
|
283251 |
103967942 |
1 |
OSN2C15H28 |
ABC2D15E28 |
-64.37 |
2.22 |
-8.6 |
0.46 |
0 |
|
|
283252 |
103968114 |
2 |
NO2C7H13 |
AB2C7D13 |
-227.12 |
5.22 |
-10.01 |
0.35 |
0 |
|
|
283253 |
103968130 |
1 |
SN2O2C16H26 |
AB2C2D16E26 |
-105.6 |
9.6 |
-8.87 |
-0.44 |
0 |
|
|
283254 |
103968131 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-123.35 |
2.95 |
-9.23 |
-0.02 |
0 |
|
|
283255 |
103968152 |
1 |
ClON3C15H24 |
ABC3D15E24 |
-47.22 |
5.45 |
-8.88 |
-0.52 |
0 |
|
|
283256 |
103968156 |
1 |
ClN3C16H26 |
AB3C16D26 |
-30.33 |
5.29 |
-8.91 |
-0.16 |
0 |
|
|
283257 |
103968356 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-118.54 |
2.44 |
-8.8 |
-0.46 |
0 |
|
|
283258 |
103968458 |
2 |
NC9H18 |
AB9C18 |
-61.23 |
2.09 |
-8.38 |
2.84 |
0 |
|
|
283259 |
103968507 |
1 |
N2C19H38 |
A2B19C38 |
-62.92 |
0.49 |
-8.35 |
2.79 |
0 |
|
|
283260 |
103968661 |
1 |
N5C14H25 |
A5B14C25 |
-17.09 |
2.99 |
-8.71 |
0.59 |
0 |
|
|
283261 |
103968714 |
1 |
FON4C14H23 |
ABC4D14E23 |
-81.43 |
4.23 |
-8.7 |
0.01 |
0 |
|
|
283262 |
103968928 |
1 |
FNOC16H22 |
ABCD16E22 |
-80.49 |
4.93 |
-9.05 |
0.22 |
0 |
|
|
283263 |
103968945 |
1 |
NO2C12H23 |
AB2C12D23 |
-102.66 |
1.28 |
-8.89 |
1.71 |
0 |
|
|
283264 |
103969002 |
2 |
NOC6H12 |
ABC6D12 |
-126.38 |
3.85 |
-9.0 |
1.33 |
0 |
|
|
283265 |
103969102 |
1 |
ClNC13H24 |
ABC13D24 |
-51.04 |
2.73 |
-8.91 |
1.26 |
0 |
|
|
283266 |
103969178 |
1 |
ClN3C13H22 |
AB3C13D22 |
5.11 |
3.51 |
-8.94 |
0.78 |
0 |
|
|
283267 |
103969200 |
1 |
ClN2C14H21 |
AB2C14D21 |
-3.38 |
3.69 |
-9.28 |
-0.12 |
0 |
|
|
283268 |
103969206 |
1 |
ClN3C15H26 |
AB3C15D26 |
-8.74 |
2.37 |
-8.84 |
0.9 |
0 |
|
|
283269 |
103969260 |
1 |
ClN4C15H19 |
AB4C15D19 |
39.25 |
1.97 |
-8.84 |
-1.04 |
0 |
|
|
283270 |
103969551 |
1 |
ClNOC18H26 |
ABCD18E26 |
-72.76 |
3.86 |
-9.61 |
0.01 |
0 |
|
|
283271 |
103970026 |
1 |
ClSN2O2C14H27 |
ABC2D2E14F27 |
-135.09 |
1.82 |
-9.63 |
0.12 |
0 |
|
|
283272 |
103970114 |
1 |
ON2F3C15H19 |
AB2C3D15E19 |
-180.56 |
4.7 |
-9.46 |
-1.05 |
0 |
|
|
283273 |
103970119 |
1 |
ON2C18H28 |
AB2C18D28 |
-61.54 |
3.6 |
-9.13 |
0.45 |
0 |
|
|
283274 |
103970420 |
1 |
SN4C13H22 |
AB4C13D22 |
39.29 |
3.51 |
-8.92 |
-0.4 |
0 |
|
|
283275 |
103970434 |
2 |
N2C7H12 |
A2B7C12 |
2.93 |
1.92 |
-8.59 |
-0.11 |
0 |
|
|
283276 |
103970605 |
1 |
ClNO3C5H10 |
ABC3D5E10 |
-147.03 |
3.41 |
-10.28 |
0.28 |
0 |
|
|
283277 |
103970749 |
1 |
ClO3C12H15 |
AB3C12D15 |
-125.45 |
1.93 |
-9.57 |
-0.3 |
0 |
|
|
283278 |
103970859 |
1 |
OC11H18 |
AB11C18 |
-69.37 |
3.56 |
-9.76 |
0.2 |
0 |
|
|
283279 |
103971186 |
1 |
OC12H16 |
AB12C16 |
-37.79 |
2.92 |
-8.88 |
0.2 |
0 |
|
|
283280 |
103971275 |
1 |
O2C9H16 |
A2B9C16 |
-106.51 |
2.19 |
-9.6 |
0.87 |
0 |
|
|
283281 |
103971503 |
1 |
O2N5C10H11 |
A2B5C10D11 |
51.33 |
3.61 |
-9.64 |
-1.83 |
0 |
|
|
283282 |
103971578 |
1 |
FO2N3C13H14 |
AB2C3D13E14 |
-41.65 |
5.54 |
-9.45 |
-1.2 |
0 |
|
|
283283 |
103971631 |
1 |
O3N4C14H14 |
A3B4C14D14 |
28.27 |
2.9 |
-9.54 |
-0.84 |
0 |
|
|
283284 |
103971639 |
1 |
O2N3C13H19 |
A2B3C13D19 |
15.84 |
4.42 |
-9.44 |
-0.33 |
0 |
|
|
283285 |
103971653 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-24.8 |
1.79 |
-9.08 |
-0.59 |
0 |
|
|
283286 |
103971664 |
1 |
FSO2N3H12C14 |
ABC2D3E12F14 |
-14.67 |
3.97 |
-9.31 |
-1.61 |
0 |
|
|
283287 |
103971698 |
1 |
ClO2N4C11H11 |
AB2C4D11E11 |
22.11 |
1.35 |
-9.52 |
-1.55 |
0 |
|
|
283288 |
103971705 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-3.07 |
3.38 |
-9.45 |
-0.33 |
0 |
|
|
283289 |
103971707 |
1 |
ClFO2N3C13H13 |
ABC2D3E13F13 |
-45.34 |
3.51 |
-9.34 |
-0.8 |
0 |
|
|
283290 |
103971739 |
2 |
ON2C6H7 |
AB2C6D7 |
22.02 |
3.83 |
-9.21 |
-0.86 |
0 |
|
|
283291 |
103971748 |
1 |
O2N3C15H17 |
A2B3C15D17 |
28.05 |
3.62 |
-9.38 |
-0.49 |
0 |
|
|
283292 |
103971750 |
1 |
FO2N3C13H14 |
AB2C3D13E14 |
-43.53 |
5.73 |
-9.41 |
-1.09 |
0 |
|
|
283293 |
103971752 |
1 |
ClO2N3C13H14 |
AB2C3D13E14 |
-5.68 |
2.31 |
-9.52 |
-1.28 |
0 |
|
|
283294 |
103971769 |
1 |
F2O2N3C12H17 |
A2B2C3D12E17 |
-145.85 |
1.77 |
-9.23 |
-0.65 |
0 |
|
|
283295 |
103971792 |
1 |
ClFO2N3H11C12 |
ABC2D3E11F12 |
-36.96 |
1.73 |
-9.3 |
-1.23 |
0 |
|
|
283296 |
103971910 |
1 |
ClF2O2N3H10C12 |
AB2C2D3E10F12 |
-80.92 |
1.91 |
-9.37 |
-1.64 |
0 |
|
|
283297 |
103972017 |
1 |
SO2N3H13C14 |
AB2C3D13E14 |
36.6 |
1.64 |
-8.92 |
-1.13 |
0 |
|
|
283298 |
103972128 |
1 |
OSN3C13H17 |
ABC3D13E17 |
38.38 |
3.09 |
-9.13 |
-0.37 |
0 |
|
|
283299 |
103972297 |
1 |
BrO2N3C15H18 |
AB2C3D15E18 |
1.3 |
5.44 |
-9.09 |
-0.95 |
0 |