List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
362189 |
127305912 |
1 |
ON3C16H25 |
AB3C16D25 |
-37.31 |
6.03 |
-8.99 |
0.63 |
0 |
|
|
362190 |
127305913 |
1 |
ON3C16H25 |
AB3C16D25 |
-36.68 |
2.11 |
-9.08 |
0.91 |
0 |
|
|
362191 |
127305914 |
1 |
N3O3C21H35 |
A3B3C21D35 |
-161.53 |
5.12 |
-8.78 |
0.8 |
0 |
|
|
362192 |
127305915 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-126.89 |
1.16 |
-9.12 |
0.72 |
0 |
|
|
362193 |
127305916 |
1 |
OSN3C13H19 |
ABC3D13E19 |
-6.85 |
4.72 |
-9.41 |
-1.25 |
0 |
|
|
362194 |
127307207 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-94.72 |
4.03 |
-9.04 |
-0.3 |
0 |
|
|
362195 |
127307208 |
1 |
O2N3C13H17 |
A2B3C13D17 |
22.91 |
7.58 |
-8.96 |
-0.18 |
0 |
|
|
362196 |
127307209 |
1 |
N2O4C17H22 |
A2B4C17D22 |
-63.68 |
4.25 |
-8.73 |
0.13 |
0 |
|
|
362197 |
127307210 |
1 |
SO3N4C18H28 |
AB3C4D18E28 |
-112.96 |
3.18 |
-8.85 |
-0.48 |
0 |
|
|
362198 |
127307211 |
1 |
O2N3C13H17 |
A2B3C13D17 |
19.88 |
7.66 |
-9.33 |
-0.11 |
0 |
|
|
362199 |
127307212 |
1 |
SO2N3C13H19 |
AB2C3D13E19 |
-85.4 |
1.89 |
-8.49 |
-0.06 |
0 |
|
|
362200 |
127307213 |
1 |
O3N4C18H26 |
A3B4C18D26 |
-23.88 |
4.69 |
-8.64 |
-0.16 |
0 |
|
|
362201 |
127307214 |
1 |
SO3N4C16H24 |
AB3C4D16E24 |
-9.93 |
6.11 |
-8.68 |
-0.45 |
0 |
|
|
362202 |
127307215 |
2 |
NOC7H12 |
ABC7D12 |
-122.59 |
3.61 |
-9.37 |
1.06 |
0 |
|
|
362203 |
127307216 |
1 |
SO2N3C12H17 |
AB2C3D12E17 |
-76.4 |
2.35 |
-8.75 |
-0.11 |
0 |
|
|
362204 |
127307217 |
1 |
SO2N4C17H26 |
AB2C4D17E26 |
-70.78 |
2.33 |
-8.66 |
-0.38 |
0 |
|
|
362205 |
127307218 |
1 |
SO2N4C18H28 |
AB2C4D18E28 |
-72.13 |
2.04 |
-8.63 |
-0.38 |
0 |
|
|
362206 |
127307219 |
1 |
N3O4C20H27 |
A3B4C20D27 |
-151.58 |
9.2 |
-8.39 |
0.41 |
0 |
|
|
362207 |
127307220 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-88.9 |
7.48 |
-8.48 |
0.57 |
0 |
|
|
362208 |
127307221 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-117.42 |
6.07 |
-9.22 |
0.96 |
0 |
|
|
362209 |
127307222 |
1 |
N3O4C19H25 |
A3B4C19D25 |
-142.97 |
8.62 |
-8.51 |
0.2 |
0 |
|
|
362210 |
127307223 |
1 |
N2O2C15H20 |
A2B2C15D20 |
-73.52 |
3.52 |
-9.22 |
0.02 |
0 |
|
|
362211 |
127307224 |
1 |
ON2C15H20 |
AB2C15D20 |
-37.99 |
4.27 |
-9.15 |
0.16 |
0 |
|
|
362212 |
127307225 |
1 |
SO2N6C15H22 |
AB2C6D15E22 |
-18.05 |
3.31 |
-8.97 |
-1.22 |
0 |
|
|
362213 |
127307226 |
1 |
O2N4C19H32 |
A2B4C19D32 |
-94.94 |
4.21 |
-8.92 |
0.34 |
0 |
|
|
362214 |
127307227 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-86.78 |
2.88 |
-8.61 |
0.36 |
0 |
|
|
362215 |
127307228 |
1 |
ON4C16H26 |
AB4C16D26 |
-37.59 |
2.69 |
-8.4 |
0.78 |
0 |
|
|
362216 |
127307229 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-123.59 |
3.05 |
-8.21 |
0.21 |
0 |
|
|
362217 |
127307230 |
1 |
ON5C20H27 |
AB5C20D27 |
0.99 |
4.76 |
-8.73 |
-0.65 |
0 |
|
|
362218 |
127307231 |
1 |
OSN4C13H20 |
ABC4D13E20 |
-8.9 |
7.11 |
-9.54 |
-1.01 |
0 |
|
|
362219 |
127307232 |
1 |
ON4C16H26 |
AB4C16D26 |
-38.38 |
5.52 |
-8.83 |
0.61 |
0 |
|
|
362220 |
127307233 |
1 |
SO2N4C19H30 |
AB2C4D19E30 |
-73.57 |
5.81 |
-8.71 |
-0.36 |
0 |
|
|
362221 |
127307234 |
1 |
O3N5C15H17 |
A3B5C15D17 |
-32.41 |
8.26 |
-8.97 |
-0.09 |
0 |
|
|
362222 |
127307235 |
1 |
ON7C15H19 |
AB7C15D19 |
51.09 |
5.0 |
-8.69 |
-0.4 |
0 |
|
|
362223 |
127307236 |
1 |
SO2N7C16H23 |
AB2C7D16E23 |
6.48 |
2.39 |
-8.99 |
-0.78 |
0 |
|
|
362224 |
127307237 |
1 |
ON5C12H19 |
AB5C12D19 |
-1.12 |
10.22 |
-9.72 |
0.24 |
0 |
|
|
362225 |
127307238 |
1 |
ON5C11H19 |
AB5C11D19 |
-5.41 |
9.24 |
-9.55 |
0.41 |
0 |
|
|
362226 |
127307239 |
1 |
ON5C14H23 |
AB5C14D23 |
-22.48 |
9.72 |
-9.65 |
0.38 |
0 |
|
|
362227 |
127307240 |
1 |
OCl2N5C15H15 |
AB2C5D15E15 |
37.55 |
9.62 |
-9.24 |
-0.74 |
0 |
|
|
362228 |
127307241 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-13.78 |
7.84 |
-9.59 |
0.15 |
0 |
|
|
362229 |
127307242 |
1 |
ON7C15H21 |
AB7C15D21 |
61.38 |
4.41 |
-9.64 |
0.05 |
0 |
|
|
362230 |
127307243 |
1 |
ON6C14H16 |
AB6C14D16 |
61.23 |
7.21 |
-9.5 |
-0.48 |
0 |
|
|
362231 |
127307244 |
1 |
ON7C14H19 |
AB7C14D19 |
65.39 |
6.22 |
-8.88 |
0.13 |
0 |
|
|
362232 |
127307245 |
1 |
ON6C14H16 |
AB6C14D16 |
65.1 |
10.42 |
-9.42 |
-0.55 |
0 |
|
|
362233 |
127307246 |
1 |
ON6C15H18 |
AB6C15D18 |
61.28 |
3.02 |
-9.35 |
-0.38 |
0 |
|
|
362234 |
127307247 |
1 |
ON6C14H16 |
AB6C14D16 |
62.08 |
8.6 |
-9.76 |
-0.48 |
0 |
|
|
362235 |
127307248 |
1 |
OSN6C16H22 |
ABC6D16E22 |
38.4 |
5.04 |
-8.86 |
-0.44 |
0 |
|
|
362236 |
127307249 |
1 |
ClON5C16H18 |
ABC5D16E18 |
33.94 |
9.91 |
-9.05 |
-0.36 |
0 |
|
|
362237 |
127307250 |
1 |
ON5C14H21 |
AB5C14D21 |
7.11 |
4.44 |
-9.54 |
0.29 |
0 |
|
|
362238 |
127307251 |
1 |
OSF3N6C13H13 |
ABC3D6E13F13 |
-82.36 |
11.09 |
-9.76 |
-1.4 |
0 |
|
|
362239 |
127307252 |
1 |
ON5C15H23 |
AB5C15D23 |
5.14 |
4.16 |
-9.55 |
0.29 |
0 |
|
|
362240 |
127307253 |
1 |
OSN6C15H18 |
ABC6D15E18 |
84.39 |
3.76 |
-9.17 |
-0.73 |
0 |
|
|
362241 |
127307254 |
1 |
ON5C14H23 |
AB5C14D23 |
-12.07 |
4.49 |
-8.57 |
-0.31 |
0 |
|
|
362242 |
127307255 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-117.47 |
6.87 |
-9.16 |
0.89 |
0 |
|
|
362243 |
127307256 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-86.73 |
3.21 |
-9.13 |
0.98 |
0 |
|
|
362244 |
127307257 |
1 |
O2N5C16H33 |
A2B5C16D33 |
-95.32 |
4.62 |
-8.64 |
1.23 |
0 |
|
|
362245 |
127307258 |
1 |
ClO3N4C18H27 |
AB3C4D18E27 |
-107.55 |
3.83 |
-8.49 |
-0.24 |
0 |
|
|
362246 |
127307259 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-128.64 |
3.25 |
-9.38 |
-0.97 |
0 |
|
|
362247 |
127307260 |
1 |
SN3O4C18H27 |
AB3C4D18E27 |
-136.7 |
3.27 |
-9.37 |
-0.94 |
0 |
|
|
362248 |
127307261 |
1 |
N2O3C19H28 |
A2B3C19D28 |
-117.33 |
5.19 |
-8.59 |
-0.05 |
0 |
|
|
362249 |
127307262 |
1 |
ON5C16H33 |
AB5C16D33 |
-65.02 |
4.05 |
-8.64 |
1.34 |
0 |
|
|
362250 |
127307263 |
1 |
S2N3O4C17H25 |
A2B3C4D17E25 |
-124.85 |
2.95 |
-9.37 |
-1.31 |
0 |
|
|
362251 |
127307264 |
1 |
O2N5C14H27 |
A2B5C14D27 |
-94.19 |
2.65 |
-8.45 |
0.82 |
0 |
|
|
362252 |
127307265 |
1 |
N3O3C20H31 |
A3B3C20D31 |
-124.81 |
3.87 |
-8.93 |
-0.08 |
0 |
|
|
362253 |
127307266 |
1 |
O2N5C20H33 |
A2B5C20D33 |
-64.96 |
4.81 |
-8.49 |
0.02 |
0 |
|
|
362254 |
127307267 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-111.09 |
5.95 |
-9.09 |
1.06 |
0 |
|
|
362255 |
127307268 |
1 |
ON5C16H31 |
AB5C16D31 |
-39.85 |
2.26 |
-8.4 |
1.28 |
0 |
|
|
362256 |
127307269 |
1 |
ON5C17H35 |
AB5C17D35 |
-83.88 |
3.9 |
-8.58 |
1.39 |
0 |
|
|
362257 |
127307270 |
1 |
O2N4C15H30 |
A2B4C15D30 |
-109.09 |
3.02 |
-8.74 |
1.49 |
0 |
|
|
362258 |
127307271 |
1 |
O2N5C14H29 |
A2B5C14D29 |
-89.12 |
3.18 |
-8.45 |
1.37 |
0 |
|
|
362259 |
127307272 |
1 |
ON5C17H35 |
AB5C17D35 |
-66.89 |
5.55 |
-8.32 |
1.47 |
0 |
|
|
362260 |
127307273 |
1 |
ON5C18H37 |
AB5C18D37 |
-62.61 |
3.43 |
-8.41 |
1.5 |
0 |
|
|
362261 |
127307274 |
1 |
N3O3C20H31 |
A3B3C20D31 |
-123.59 |
4.6 |
-8.59 |
0.0 |
0 |
|
|
362262 |
127307275 |
1 |
ON7C16H25 |
AB7C16D25 |
22.2 |
5.5 |
-8.81 |
-0.67 |
0 |
|
|
362263 |
127307276 |
1 |
SO3N4C19H30 |
AB3C4D19E30 |
-114.59 |
7.37 |
-9.0 |
0.26 |
0 |
|
|
362264 |
127307277 |
2 |
ON2C10H15 |
AB2C10D15 |
-75.81 |
5.26 |
-8.79 |
0.09 |
0 |
|
|
362265 |
127307278 |
1 |
ON5C18H29 |
AB5C18D29 |
-12.8 |
4.13 |
-8.38 |
0.09 |
0 |
|
|
362266 |
127307279 |
1 |
O2N5C17H35 |
A2B5C17D35 |
-97.95 |
3.37 |
-8.46 |
1.4 |
0 |
|
|
362267 |
127307280 |
1 |
SO2N4C17H26 |
AB2C4D17E26 |
-67.77 |
5.31 |
-9.41 |
-0.52 |
0 |
|
|
362268 |
127307281 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-77.95 |
4.91 |
-9.45 |
0.86 |
0 |
|
|
362269 |
127307282 |
1 |
O2N5C16H25 |
A2B5C16D25 |
-39.31 |
6.36 |
-9.27 |
0.26 |
0 |
|
|
362270 |
127307289 |
1 |
O2N5C15H31 |
A2B5C15D31 |
-90.84 |
4.99 |
-8.56 |
1.44 |
0 |
|
|
362271 |
127307290 |
2 |
FON2C10H15 |
ABC2D10E15 |
-167.01 |
1.22 |
-8.76 |
-0.24 |
0 |
|
|
362272 |
127307291 |
1 |
ON6C16H28 |
AB6C16D28 |
-13.9 |
3.37 |
-8.5 |
-0.12 |
0 |
|
|
362273 |
127307292 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-70.65 |
6.5 |
-8.42 |
0.02 |
0 |
|
|
362274 |
127307293 |
2 |
ON2C8H16 |
AB2C8D16 |
-114.13 |
3.45 |
-8.76 |
1.45 |
0 |
|
|
362275 |
127307294 |
1 |
O2N5C15H31 |
A2B5C15D31 |
-93.02 |
2.86 |
-8.65 |
1.24 |
0 |
|
|
362276 |
127307295 |
2 |
FON2C10H15 |
ABC2D10E15 |
-172.55 |
3.26 |
-8.57 |
-0.58 |
0 |
|
|
362277 |
127307296 |
1 |
ON5C19H29 |
AB5C19D29 |
-5.95 |
1.63 |
-8.54 |
-0.06 |
0 |
|
|
362278 |
127307297 |
1 |
O2N4C17H32 |
A2B4C17D32 |
-129.53 |
3.08 |
-8.65 |
0.97 |
0 |
|
|
362279 |
127307298 |
1 |
O2N5C16H31 |
A2B5C16D31 |
-107.24 |
5.16 |
-8.53 |
1.06 |
0 |
|
|
362280 |
127307299 |
1 |
ON6C19H32 |
AB6C19D32 |
-24.05 |
3.83 |
-8.47 |
-0.02 |
0 |
|
|
362281 |
127307300 |
1 |
SO3N4C16H30 |
AB3C4D16E30 |
-128.8 |
5.62 |
-8.89 |
0.25 |
0 |
|
|
362282 |
127307301 |
1 |
ON5C16H27 |
AB5C16D27 |
1.53 |
1.88 |
-8.78 |
0.45 |
0 |
|
|
362283 |
127307302 |
1 |
ON5C17H33 |
AB5C17D33 |
-44.3 |
2.49 |
-8.42 |
1.24 |
0 |
|
|
362284 |
127307303 |
1 |
O2N5C19H37 |
A2B5C19D37 |
-122.1 |
3.72 |
-8.81 |
1.02 |
0 |
|
|
362285 |
127307304 |
1 |
SN3O3C12H23 |
AB3C3D12E23 |
-129.65 |
5.74 |
-9.28 |
0.28 |
0 |
|
|
362286 |
127307308 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-137.83 |
3.4 |
-9.14 |
0.59 |
0 |
|
|
362287 |
127307309 |
1 |
O3N5C15H29 |
A3B5C15D29 |
-136.31 |
3.13 |
-8.43 |
0.65 |
0 |
|
|
362288 |
127307310 |
1 |
ClON6C16H23 |
ABC6D16E23 |
3.19 |
3.61 |
-8.47 |
-1.03 |
0 |