List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
344184 |
127267360 |
1 |
SN2O3C17H20 |
AB2C3D17E20 |
-61.54 |
4.89 |
-9.2 |
-0.78 |
0 |
|
|
344185 |
127267361 |
1 |
SN2O3C15H18 |
AB2C3D15E18 |
-79.67 |
4.75 |
-9.26 |
-0.77 |
0 |
|
|
344186 |
127267362 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-52.91 |
2.83 |
-8.7 |
-0.16 |
0 |
|
|
344187 |
127267363 |
1 |
OSF3N3C13H18 |
ABC3D3E13F18 |
-185.16 |
4.35 |
-9.22 |
-0.78 |
0 |
|
|
344188 |
127267364 |
1 |
OSN3C12H21 |
ABC3D12E21 |
-29.62 |
2.63 |
-9.11 |
-0.66 |
0 |
|
|
344189 |
127267365 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-83.91 |
4.7 |
-9.74 |
-0.55 |
0 |
|
|
344190 |
127267366 |
1 |
OS2N3C17H19 |
AB2C3D17E19 |
25.17 |
3.99 |
-8.42 |
-1.02 |
0 |
|
|
344191 |
127267367 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-21.0 |
3.15 |
-9.07 |
-0.41 |
0 |
|
|
344192 |
127267368 |
1 |
O2N3C19H25 |
A2B3C19D25 |
-35.23 |
2.38 |
-9.49 |
-0.32 |
0 |
|
|
344193 |
127267369 |
1 |
ON3C19H23 |
AB3C19D23 |
22.85 |
4.78 |
-8.52 |
-0.47 |
0 |
|
|
344194 |
127267370 |
1 |
N2F3O3H13C16 |
A2B3C3D13E16 |
-189.74 |
2.27 |
-9.42 |
-1.23 |
0 |
|
|
344195 |
127267371 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-67.83 |
2.56 |
-8.63 |
0.26 |
0 |
|
|
344196 |
127267372 |
2 |
ON2C9H13 |
AB2C9D13 |
-57.65 |
3.55 |
-9.09 |
-0.39 |
0 |
|
|
344197 |
127267373 |
2 |
ON2C9H14 |
AB2C9D14 |
-67.14 |
5.44 |
-9.09 |
0.29 |
0 |
|
|
344198 |
127267374 |
1 |
ON4C18H26 |
AB4C18D26 |
-9.45 |
3.3 |
-8.73 |
-0.05 |
0 |
|
|
344199 |
127267375 |
1 |
ON6C14H22 |
AB6C14D22 |
37.21 |
4.41 |
-8.63 |
-1.71 |
0 |
|
|
344200 |
127267376 |
1 |
ClFNSO5C11H13 |
ABCDE5F11G13 |
-240.33 |
1.62 |
-9.91 |
-1.73 |
0 |
|
|
344201 |
127267377 |
1 |
FON5C18H18 |
ABC5D18E18 |
9.25 |
6.22 |
-8.78 |
-0.53 |
0 |
|
|
344202 |
127267378 |
1 |
SN3O4C15H15 |
AB3C4D15E15 |
-92.47 |
3.81 |
-9.31 |
-1.83 |
0 |
|
|
344203 |
127267379 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-123.1 |
7.33 |
-9.3 |
0.26 |
0 |
|
|
344204 |
127267380 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-25.83 |
7.07 |
-8.29 |
0.13 |
0 |
|
|
344205 |
127267381 |
1 |
ON6C18H20 |
AB6C18D20 |
71.36 |
5.45 |
-9.59 |
-0.94 |
0 |
|
|
344206 |
127267382 |
1 |
ON2F3C11H11 |
AB2C3D11E11 |
-173.04 |
5.32 |
-10.14 |
-0.92 |
0 |
|
|
344207 |
127267383 |
1 |
FSN2O4H17C18 |
ABC2D4E17F18 |
-193.72 |
2.68 |
-8.69 |
-1.09 |
0 |
|
|
344208 |
127267384 |
1 |
FNS2O5H16C17 |
ABC2D5E16F17 |
-223.23 |
2.2 |
-8.94 |
-1.4 |
0 |
|
|
344209 |
127267385 |
1 |
FSN2O3H13C17 |
ABC2D3E13F17 |
-103.05 |
3.0 |
-9.47 |
-1.58 |
0 |
|
|
344210 |
127267386 |
1 |
ClNSO3H18C22 |
ABCD3E18F22 |
-72.84 |
5.44 |
-9.36 |
-1.12 |
0 |
|
|
344211 |
127267387 |
1 |
ClNSO3C18H18 |
ABCD3E18F18 |
-113.18 |
5.99 |
-9.25 |
-1.18 |
0 |
|
|
344212 |
127267388 |
1 |
ClNSO3C18H18 |
ABCD3E18F18 |
-111.96 |
4.63 |
-8.89 |
-0.99 |
0 |
|
|
344213 |
127267389 |
1 |
ClSN3O5C16H20 |
ABC3D5E16F20 |
-163.3 |
5.24 |
-9.39 |
-1.03 |
0 |
|
|
344214 |
127267390 |
1 |
NO2H11C12 |
AB2C11D12 |
-18.41 |
3.85 |
-9.3 |
-0.58 |
0 |
|
|
344215 |
127267391 |
1 |
NO3C17H23 |
AB3C17D23 |
-95.73 |
2.25 |
-8.16 |
0.31 |
0 |
|
|
344216 |
127267392 |
1 |
FN2O2C15H15 |
AB2C2D15E15 |
-42.67 |
2.56 |
-9.44 |
-0.99 |
0 |
|
|
344217 |
127267393 |
1 |
ON2C16H22 |
AB2C16D22 |
-18.21 |
5.7 |
-9.12 |
-0.36 |
0 |
|
|
344218 |
127267394 |
2 |
ON2C8H9 |
AB2C8D9 |
-6.65 |
3.97 |
-8.91 |
-0.52 |
0 |
|
|
344219 |
127267395 |
1 |
NOF2H11C12 |
ABC2D11E12 |
-77.49 |
4.51 |
-9.67 |
-0.52 |
0 |
|
|
344220 |
127267396 |
1 |
N2O2C11H12 |
A2B2C11D12 |
-24.27 |
4.39 |
-9.7 |
-0.51 |
0 |
|
|
344221 |
127267397 |
1 |
FON4C13H19 |
ABC4D13E19 |
-36.85 |
3.75 |
-8.81 |
-0.05 |
0 |
|
|
344222 |
127267398 |
1 |
FON5C15H22 |
ABC5D15E22 |
-37.84 |
4.66 |
-8.33 |
0.02 |
0 |
|
|
344223 |
127267399 |
1 |
NO3C15H19 |
AB3C15D19 |
-90.65 |
4.21 |
-9.38 |
0.17 |
0 |
|
|
344224 |
127267400 |
1 |
N2O3C13H16 |
A2B3C13D16 |
-79.29 |
4.19 |
-9.12 |
-0.19 |
0 |
|
|
344225 |
127267401 |
2 |
NO2C9H12 |
AB2C9D12 |
-157.03 |
5.4 |
-8.91 |
-0.15 |
0 |
|
|
344226 |
127267402 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-90.45 |
2.35 |
-9.24 |
-1.21 |
0 |
|
|
344227 |
127267403 |
1 |
ClFON3H13C14 |
ABCD3E13F14 |
-38.48 |
4.37 |
-9.53 |
-0.86 |
0 |
|
|
344228 |
127267404 |
1 |
N4O4C17H20 |
A4B4C17D20 |
-77.38 |
6.06 |
-9.02 |
-1.32 |
0 |
|
|
344229 |
127267405 |
1 |
N3O4C13H15 |
A3B4C13D15 |
-100.48 |
5.86 |
-9.43 |
-0.58 |
0 |
|
|
344230 |
127267406 |
1 |
ON3C16H17 |
AB3C16D17 |
16.04 |
8.81 |
-8.74 |
-0.4 |
0 |
|
|
344231 |
127267407 |
1 |
ClO2N3C17H18 |
AB2C3D17E18 |
-17.56 |
4.97 |
-8.73 |
-1.35 |
0 |
|
|
344232 |
127267408 |
2 |
ON2C10H10 |
AB2C10D10 |
20.08 |
4.58 |
-9.28 |
-0.68 |
0 |
|
|
344233 |
127267409 |
1 |
NSO4C15H17 |
ABC4D15E17 |
-140.29 |
1.92 |
-8.85 |
-1.21 |
0 |
|
|
344234 |
127267410 |
1 |
NSF3O4H12C14 |
ABC3D4E12F14 |
-285.38 |
3.72 |
-8.96 |
-1.29 |
0 |
|
|
344235 |
127267411 |
1 |
ON3C16H19 |
AB3C16D19 |
-0.82 |
3.86 |
-9.28 |
0.14 |
0 |
|
|
344236 |
127267412 |
1 |
FO3N4H13C14 |
AB3C4D13E14 |
-30.57 |
5.56 |
-9.56 |
-1.91 |
0 |
|
|
344237 |
127267413 |
1 |
N3O6C14H15 |
A3B6C14D15 |
-194.38 |
2.51 |
-8.62 |
-0.85 |
0 |
|
|
344238 |
127267414 |
1 |
SN3O3C17H21 |
AB3C3D17E21 |
-82.16 |
2.75 |
-9.42 |
-0.57 |
0 |
|
|
344239 |
127267415 |
1 |
ClSO3N4C15H27 |
ABC3D4E15F27 |
-158.3 |
4.07 |
-8.8 |
-0.22 |
0 |
|
|
344240 |
127267416 |
1 |
SO3N4C15H26 |
AB3C4D15E26 |
-110.28 |
4.56 |
-8.35 |
-0.22 |
0 |
|
|
344241 |
127267417 |
1 |
ON3C13H13 |
AB3C13D13 |
26.32 |
6.21 |
-9.65 |
-1.08 |
0 |
|
|
344242 |
127267418 |
1 |
N2O2H10C11 |
A2B2C10D11 |
12.93 |
2.53 |
-9.52 |
-0.65 |
0 |
|
|
344243 |
127267419 |
1 |
O2N3C16H17 |
A2B3C16D17 |
-7.8 |
1.9 |
-9.2 |
-0.29 |
0 |
|
|
344244 |
127267420 |
1 |
FN2O2H9C11 |
AB2C2D9E11 |
-56.59 |
1.65 |
-9.76 |
-1.02 |
0 |
|
|
344245 |
127267421 |
1 |
O3N5C16H25 |
A3B5C16D25 |
-89.75 |
5.94 |
-9.6 |
0.0 |
0 |
|
|
344246 |
127267422 |
1 |
ON3C11H15 |
AB3C11D15 |
10.54 |
6.11 |
-9.13 |
0.37 |
0 |
|
|
344247 |
127267423 |
1 |
NO2C12H13 |
AB2C12D13 |
-45.74 |
2.46 |
-9.51 |
-0.03 |
0 |
|
|
344248 |
127267424 |
2 |
NOC7H9 |
ABC7D9 |
-42.79 |
5.1 |
-9.09 |
-0.1 |
0 |
|
|
344249 |
127267425 |
1 |
ON4C8H12 |
AB4C8D12 |
24.6 |
1.75 |
-9.66 |
-0.04 |
0 |
|
|
344250 |
127267426 |
1 |
ClNO2C15H18 |
ABC2D15E18 |
-62.33 |
6.59 |
-8.92 |
-0.28 |
0 |
|
|
344251 |
127267427 |
2 |
NOC7H7 |
ABC7D7 |
-8.26 |
1.76 |
-9.45 |
-0.11 |
0 |
|
|
344252 |
127267428 |
1 |
O3N5C16H25 |
A3B5C16D25 |
-89.65 |
1.48 |
-9.47 |
-0.14 |
0 |
|
|
344253 |
127267429 |
1 |
NO3C17H21 |
AB3C17D21 |
-113.65 |
1.44 |
-9.48 |
0.03 |
0 |
|
|
344254 |
127267430 |
1 |
N2O2F3H13C14 |
A2B2C3D13E14 |
-194.78 |
5.96 |
-9.22 |
-0.45 |
0 |
|
|
344255 |
127267431 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-22.52 |
5.29 |
-9.29 |
-0.3 |
0 |
|
|
344256 |
127267432 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-69.46 |
3.36 |
-9.05 |
-1.01 |
0 |
|
|
344257 |
127267433 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-22.38 |
4.96 |
-8.76 |
-1.1 |
0 |
|
|
344258 |
127267434 |
1 |
OSN3C16H19 |
ABC3D16E19 |
-2.17 |
3.77 |
-8.89 |
-0.51 |
0 |
|
|
344259 |
127267435 |
1 |
NO2C20H27 |
AB2C20D27 |
-82.01 |
3.3 |
-9.37 |
0.13 |
0 |
|
|
344260 |
127267436 |
1 |
NO3C16H21 |
AB3C16D21 |
-111.19 |
4.02 |
-8.87 |
0.05 |
0 |
|
|
344261 |
127267437 |
1 |
N4O4C17H22 |
A4B4C17D22 |
-92.93 |
3.17 |
-8.9 |
-0.7 |
0 |
|
|
344262 |
127267438 |
1 |
O2N3C17H19 |
A2B3C17D19 |
-15.49 |
3.14 |
-9.26 |
-0.77 |
0 |
|
|
344263 |
127267439 |
1 |
NO4C20H25 |
AB4C20D25 |
-147.45 |
4.5 |
-9.06 |
0.1 |
0 |
|
|
344264 |
127267440 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-73.86 |
7.6 |
-8.61 |
-0.11 |
0 |
|
|
344265 |
127267441 |
1 |
N3O3C17H19 |
A3B3C17D19 |
-83.17 |
1.87 |
-8.89 |
-0.1 |
0 |
|
|
344266 |
127267442 |
1 |
N3O4C15H25 |
A3B4C15D25 |
-160.44 |
4.47 |
-9.08 |
0.16 |
0 |
|
|
344267 |
127267443 |
1 |
FO2N3C18H22 |
AB2C3D18E22 |
-92.97 |
4.85 |
-9.29 |
-0.12 |
0 |
|
|
344268 |
127267444 |
1 |
OSN4C18H18 |
ABC4D18E18 |
38.88 |
2.93 |
-9.2 |
-1.0 |
0 |
|
|
344269 |
127267445 |
1 |
SO2N3C18H21 |
AB2C3D18E21 |
-50.22 |
2.79 |
-8.43 |
-0.55 |
0 |
|
|
344270 |
127267446 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-21.88 |
4.13 |
-9.67 |
-0.27 |
0 |
|
|
344271 |
127267447 |
1 |
O2N5C16H17 |
A2B5C16D17 |
8.14 |
5.62 |
-9.29 |
-0.78 |
0 |
|
|
344272 |
127267448 |
1 |
FN3O3C17H18 |
AB3C3D17E18 |
-163.13 |
5.14 |
-9.91 |
-0.79 |
0 |
|
|
344273 |
127267449 |
1 |
SO2N3C15H17 |
AB2C3D15E17 |
-59.84 |
8.68 |
-9.03 |
-0.99 |
0 |
|
|
344274 |
127267450 |
1 |
ClSO2N3C15H16 |
ABC2D3E15F16 |
-54.91 |
5.25 |
-9.31 |
-0.76 |
0 |
|
|
344275 |
127267451 |
1 |
O2N6C17H20 |
A2B6C17D20 |
-6.96 |
8.54 |
-9.01 |
-0.62 |
0 |
|
|
344276 |
127267452 |
1 |
OSN5C15H17 |
ABC5D15E17 |
47.7 |
4.19 |
-8.83 |
-0.73 |
0 |
|
|
344277 |
127267453 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-92.61 |
2.22 |
-9.27 |
-0.62 |
0 |
|
|
344278 |
127267454 |
1 |
OSN4C18H18 |
ABC4D18E18 |
51.93 |
6.38 |
-9.02 |
-0.71 |
0 |
|
|
344279 |
127267455 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-101.38 |
7.43 |
-9.36 |
-0.45 |
0 |
|
|
344280 |
127267456 |
1 |
SN2O3C17H28 |
AB2C3D17E28 |
-143.29 |
2.25 |
-9.29 |
-0.48 |
0 |
|
|
344281 |
127267457 |
1 |
OSN5C17H25 |
ABC5D17E25 |
14.17 |
3.4 |
-9.13 |
-0.23 |
0 |
|
|
344282 |
127267458 |
2 |
ON2C9H11 |
AB2C9D11 |
-25.15 |
4.24 |
-9.05 |
-0.6 |
0 |
|
|
344283 |
127267459 |
1 |
OSN3C12H13 |
ABC3D12E13 |
21.52 |
4.07 |
-9.11 |
-0.73 |
0 |