List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
143234 |
53170098 |
1 |
O2N5H17C19 |
A2B5C17D19 |
87.8 |
5.04 |
-9.15 |
-0.97 |
0 |
|
|
143235 |
53170573 |
1 |
SN2O3C18H22 |
AB2C3D18E22 |
-88.3 |
5.85 |
-9.39 |
-0.71 |
0 |
|
|
143236 |
53170574 |
1 |
SN2O3C19H24 |
AB2C3D19E24 |
-97.7 |
5.88 |
-9.55 |
-0.67 |
0 |
|
|
143237 |
53170575 |
1 |
SN2O3C19H24 |
AB2C3D19E24 |
-98.64 |
6.25 |
-9.48 |
-0.65 |
0 |
|
|
143238 |
53170576 |
1 |
SN2O3C20H26 |
AB2C3D20E26 |
-107.27 |
5.93 |
-9.34 |
-0.65 |
0 |
|
|
143239 |
53170577 |
1 |
SN2O3C20H26 |
AB2C3D20E26 |
-107.32 |
7.13 |
-9.46 |
-0.6 |
0 |
|
|
143240 |
53170578 |
1 |
SN2O3C20H24 |
AB2C3D20E24 |
-72.37 |
5.4 |
-9.25 |
-0.74 |
0 |
|
|
143241 |
53170579 |
1 |
SN2O4C19H24 |
AB2C4D19E24 |
-129.76 |
5.53 |
-9.17 |
-0.64 |
0 |
|
|
143242 |
53170580 |
1 |
SN2O4C19H24 |
AB2C4D19E24 |
-129.46 |
6.45 |
-9.17 |
-0.65 |
0 |
|
|
143243 |
53171130 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-30.25 |
5.53 |
-9.17 |
-0.89 |
0 |
|
|
143244 |
53171345 |
1 |
SO3N4H22C23 |
AB3C4D22E23 |
-3.78 |
2.95 |
-9.56 |
-1.19 |
0 |
|
|
143245 |
53171487 |
1 |
SN3O3C24H33 |
AB3C3D24E33 |
-87.58 |
7.61 |
-9.43 |
-1.03 |
0 |
|
|
143246 |
53171494 |
1 |
ClS2N3O3C20H20 |
AB2C3D3E20F20 |
-27.62 |
4.59 |
-9.58 |
-1.24 |
0 |
|
|
143247 |
53172157 |
1 |
ON6C20H22 |
AB6C20D22 |
52.05 |
6.37 |
-9.1 |
-1.18 |
0 |
|
|
143248 |
53172718 |
1 |
O3N4C20H20 |
A3B4C20D20 |
7.32 |
5.13 |
-8.99 |
-1.06 |
0 |
|
|
143249 |
53172856 |
1 |
SO2N4C22H24 |
AB2C4D22E24 |
-2.11 |
5.08 |
-8.41 |
-0.7 |
0 |
|
|
143250 |
53172857 |
1 |
SO2N5C23H25 |
AB2C5D23E25 |
-15.25 |
7.1 |
-8.5 |
-0.8 |
0 |
|
|
143251 |
53173143 |
1 |
FOSN4H17C20 |
ABCD4E17F20 |
8.55 |
6.84 |
-8.71 |
-1.18 |
0 |
|
|
143252 |
53173410 |
1 |
FSO2N3H16C21 |
ABC2D3E16F21 |
-42.06 |
4.93 |
-9.21 |
-1.29 |
0 |
|
|
143253 |
53173989 |
1 |
FSO2N3H12C14 |
ABC2D3E12F14 |
-50.15 |
2.85 |
-9.68 |
-0.87 |
0 |
|
|
143254 |
53174330 |
1 |
OF2N5C22H29 |
AB2C5D22E29 |
-109.12 |
3.6 |
-8.61 |
-0.61 |
0 |
|
|
143255 |
53174522 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-26.05 |
4.26 |
-8.8 |
0.0 |
0 |
|
|
143256 |
53174559 |
2 |
NOC7H8 |
ABC7D8 |
-65.53 |
5.39 |
-9.05 |
-1.02 |
0 |
|
|
143257 |
53174636 |
1 |
O2N4C21H30 |
A2B4C21D30 |
-72.74 |
2.11 |
-8.67 |
-0.85 |
0 |
|
|
143258 |
53174681 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-80.35 |
6.25 |
-8.6 |
-0.89 |
0 |
|
|
143259 |
53174812 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-76.48 |
6.25 |
-9.0 |
-0.88 |
0 |
|
|
143260 |
53175714 |
1 |
FSN4O4C21H23 |
ABC4D4E21F23 |
-92.37 |
3.55 |
-8.42 |
-1.55 |
0 |
|
|
143261 |
53175753 |
1 |
FSN4O4C17H17 |
ABC4D4E17F17 |
-86.65 |
7.16 |
-9.15 |
-1.1 |
0 |
|
|
143262 |
53175985 |
1 |
FSO3N4C15H15 |
ABC3D4E15F15 |
-91.75 |
7.31 |
-8.76 |
-1.12 |
0 |
|
|
143263 |
53175986 |
1 |
ClSN4O4C15H15 |
ABC4D4E15F15 |
-82.27 |
7.73 |
-8.56 |
-1.08 |
0 |
|
|
143264 |
53176473 |
1 |
FO4N5H18C21 |
AB4C5D18E21 |
-97.42 |
3.38 |
-9.32 |
-0.99 |
0 |
|
|
143265 |
53176496 |
1 |
FO2N5C19H22 |
AB2C5D19E22 |
-61.59 |
6.35 |
-8.62 |
-0.46 |
0 |
|
|
143266 |
53176520 |
1 |
ClFO2N5H19C21 |
ABC2D5E19F21 |
-30.43 |
4.58 |
-8.76 |
-0.53 |
0 |
|
|
143267 |
53176592 |
1 |
N3O5H13C19 |
A3B5C13D19 |
-71.68 |
3.22 |
-9.02 |
-2.22 |
0 |
|
|
143268 |
53176619 |
1 |
ClFN3O3H9C17 |
ABC3D3E9F17 |
-43.86 |
2.11 |
-9.04 |
-2.14 |
0 |
|
|
143269 |
53176884 |
1 |
N3O3H17C20 |
A3B3C17D20 |
-14.23 |
5.42 |
-8.55 |
-1.69 |
0 |
|
|
143270 |
53177296 |
1 |
SN2O4C20H22 |
AB2C4D20E22 |
-109.66 |
10.91 |
-8.49 |
-0.47 |
0 |
|
|
143271 |
53177335 |
2 |
NO2C11H12 |
AB2C11D12 |
-115.52 |
4.63 |
-8.41 |
-0.33 |
0 |
|
|
143272 |
53177336 |
1 |
N3O3H19C21 |
A3B3C19D21 |
-35.54 |
8.94 |
-8.56 |
-0.97 |
0 |
|
|
143273 |
53177388 |
1 |
ClFN3O4H15C22 |
ABC3D4E15F22 |
-131.81 |
4.58 |
-8.86 |
-1.23 |
0 |
|
|
143274 |
53177463 |
1 |
FN3O3H16C22 |
AB3C3D16E22 |
-88.25 |
4.45 |
-9.28 |
-0.92 |
0 |
|
|
143275 |
53177496 |
1 |
ClN3O3H16C22 |
AB3C3D16E22 |
-54.7 |
2.77 |
-9.43 |
-1.17 |
0 |
|
|
143276 |
53177497 |
1 |
ClN3O3H16C22 |
AB3C3D16E22 |
-54.4 |
2.29 |
-9.27 |
-1.16 |
0 |
|
|
143277 |
53177789 |
1 |
F2O3N4H14C20 |
A2B3C4D14E20 |
-97.03 |
14.12 |
-8.49 |
-1.77 |
0 |
|
|
143278 |
53178009 |
1 |
O2N5C18H19 |
A2B5C18D19 |
54.73 |
3.08 |
-8.99 |
-0.64 |
0 |
|
|
143279 |
53178553 |
1 |
O2N6H20C21 |
A2B6C20D21 |
73.3 |
4.87 |
-9.38 |
-1.82 |
0 |
|
|
143280 |
53179094 |
1 |
O3N6H20C21 |
A3B6C20D21 |
34.56 |
2.34 |
-8.92 |
-1.74 |
0 |
|
|
143281 |
53179095 |
1 |
O3N6H20C21 |
A3B6C20D21 |
35.13 |
3.09 |
-8.85 |
-1.74 |
0 |
|
|
143282 |
53179346 |
1 |
O3N6C17H20 |
A3B6C17D20 |
2.98 |
3.31 |
-9.64 |
-1.55 |
0 |
|
|
143283 |
53179581 |
1 |
O2N6C21H22 |
A2B6C21D22 |
48.27 |
3.22 |
-8.86 |
-1.6 |
0 |
|
|
143284 |
53179979 |
2 |
ON3C11H12 |
AB3C11D12 |
72.46 |
7.3 |
-9.1 |
-1.02 |
0 |
|
|
143285 |
53179980 |
2 |
ON3C11H12 |
AB3C11D12 |
75.42 |
3.04 |
-9.11 |
-0.92 |
0 |
|
|
143286 |
53180237 |
1 |
SN3O3C15H15 |
AB3C3D15E15 |
-42.98 |
8.62 |
-9.24 |
-0.88 |
0 |
|
|
143287 |
53180252 |
1 |
SN3O4H13C15 |
AB3C4D13E15 |
-72.96 |
8.95 |
-9.14 |
-0.91 |
0 |
|
|
143288 |
53180321 |
1 |
ClSN3O4H16C20 |
ABC3D4E16F20 |
-75.64 |
5.69 |
-9.04 |
-1.22 |
0 |
|
|
143289 |
53180322 |
1 |
ClSN3O4H16C20 |
ABC3D4E16F20 |
-78.09 |
5.63 |
-9.13 |
-1.27 |
0 |
|
|
143290 |
53180323 |
1 |
FSN3O4H16C20 |
ABC3D4E16F20 |
-114.02 |
4.66 |
-9.04 |
-1.24 |
0 |
|
|
143291 |
53180541 |
1 |
FN3O3C18H22 |
AB3C3D18E22 |
-139.62 |
3.31 |
-8.95 |
-0.83 |
0 |
|
|
143292 |
53180835 |
1 |
ON4C21H26 |
AB4C21D26 |
10.77 |
5.04 |
-8.64 |
-0.2 |
0 |
|
|
143293 |
53181599 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-103.06 |
6.28 |
-8.43 |
-0.1 |
0 |
|
|
143294 |
53181600 |
1 |
ClO2N4C19H23 |
AB2C4D19E23 |
-69.06 |
5.67 |
-8.6 |
-0.29 |
0 |
|
|
143295 |
53181712 |
1 |
SO3N5C19H33 |
AB3C5D19E33 |
-123.38 |
9.18 |
-8.19 |
0.23 |
0 |
|
|
143296 |
53181713 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-60.34 |
6.07 |
-8.23 |
0.06 |
0 |
|
|
143297 |
53181895 |
1 |
N2O5C17H24 |
A2B5C17D24 |
-190.25 |
3.84 |
-8.59 |
-0.36 |
0 |
|
|
143298 |
53181919 |
1 |
O2N3C17H21 |
A2B3C17D21 |
-26.02 |
5.6 |
-9.69 |
-0.23 |
0 |
|
|
143299 |
53182709 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
-11.87 |
7.08 |
-8.74 |
-0.79 |
0 |
|
|
143300 |
53182953 |
1 |
FSN3O3C17H20 |
ABC3D3E17F20 |
-130.59 |
8.12 |
-9.13 |
-0.22 |
0 |
|
|
143301 |
53182954 |
1 |
FSN3O3C17H20 |
ABC3D3E17F20 |
-131.11 |
9.19 |
-8.52 |
-0.2 |
0 |
|
|
143302 |
53183007 |
1 |
ClSN4O4C20H21 |
ABC4D4E20F21 |
-80.61 |
6.85 |
-8.7 |
-1.35 |
0 |
|
|
143303 |
53183908 |
1 |
ClO3N4H15C20 |
AB3C4D15E20 |
0.14 |
8.53 |
-9.05 |
-1.12 |
0 |
|
|
143304 |
53184199 |
1 |
SF2O2N5C17H19 |
AB2C2D5E17F19 |
-83.56 |
5.52 |
-7.96 |
-1.15 |
0 |
|
|
143305 |
53184404 |
1 |
O3N4C23H28 |
A3B4C23D28 |
-51.02 |
5.77 |
-8.58 |
-0.11 |
0 |
|
|
143306 |
53184405 |
1 |
O3N4C23H28 |
A3B4C23D28 |
-47.29 |
4.67 |
-8.29 |
-0.27 |
0 |
|
|
143307 |
53184569 |
1 |
N2O3C21H30 |
A2B3C21D30 |
-130.11 |
6.56 |
-9.39 |
-0.19 |
0 |
|
|
143308 |
53185095 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-72.79 |
4.08 |
-8.87 |
-0.08 |
0 |
|
|
143309 |
53185215 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-18.74 |
5.8 |
-8.99 |
0.02 |
0 |
|
|
143310 |
53185216 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-33.21 |
2.98 |
-9.01 |
-0.07 |
0 |
|
|
143311 |
53185217 |
1 |
O3N4C16H26 |
A3B4C16D26 |
-108.65 |
0.94 |
-9.09 |
-0.06 |
0 |
|
|
143312 |
53185555 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-54.57 |
2.71 |
-8.65 |
-0.35 |
0 |
|
|
143313 |
53185951 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-46.42 |
2.09 |
-8.42 |
0.16 |
0 |
|
|
143314 |
53186161 |
1 |
ON4C22H30 |
AB4C22D30 |
-5.07 |
5.16 |
-8.19 |
0.19 |
0 |
|
|
143315 |
53186581 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-29.83 |
4.94 |
-8.99 |
-1.13 |
0 |
|
|
143316 |
53186674 |
2 |
N2O2H10C11 |
A2B2C10D11 |
-72.2 |
4.04 |
-9.1 |
-1.39 |
0 |
|
|
143317 |
53186851 |
1 |
SO2N4H16C19 |
AB2C4D16E19 |
47.24 |
4.47 |
-9.21 |
-0.61 |
0 |
|
|
143318 |
53187447 |
1 |
F3O3N4C19H19 |
A3B3C4D19E19 |
-237.45 |
2.45 |
-8.57 |
-0.53 |
0 |
|
|
143319 |
53187900 |
1 |
SN2O4C23H28 |
AB2C4D23E28 |
-137.88 |
6.18 |
-9.02 |
-0.52 |
0 |
|
|
143320 |
53187924 |
1 |
SN2O4C22H26 |
AB2C4D22E26 |
-130.34 |
5.87 |
-8.38 |
-0.65 |
0 |
|
|
143321 |
53188121 |
1 |
SO3N4C21H26 |
AB3C4D21E26 |
-85.14 |
4.84 |
-8.24 |
-0.53 |
0 |
|
|
143322 |
53189108 |
1 |
ON4H16C17 |
AB4C16D17 |
60.69 |
2.99 |
-9.19 |
-1.31 |
0 |
|
|
143323 |
53189148 |
1 |
SN2O4C19H22 |
AB2C4D19E22 |
-92.57 |
8.84 |
-8.75 |
-0.75 |
0 |
|
|
143324 |
53189227 |
1 |
O2F3N4C20H23 |
A2B3C4D20E23 |
-199.72 |
4.22 |
-9.07 |
-0.8 |
0 |
|
|
143325 |
53189933 |
1 |
O2N6C19H20 |
A2B6C19D20 |
46.08 |
4.12 |
-8.38 |
-0.75 |
0 |
|
|
143326 |
53189934 |
1 |
OF3N6H17C19 |
AB3C6D17E19 |
-75.44 |
6.38 |
-8.47 |
-1.09 |
0 |
|
|
143327 |
53189935 |
1 |
OSN6C17H18 |
ABC6D17E18 |
80.24 |
5.47 |
-8.64 |
-0.9 |
0 |
|
|
143328 |
53190306 |
1 |
OSN4C16H22 |
ABC4D16E22 |
0.62 |
5.17 |
-8.86 |
-1.31 |
0 |
|
|
143329 |
53190808 |
1 |
ON7C16H17 |
AB7C16D17 |
77.6 |
4.41 |
-8.72 |
-1.17 |
0 |
|
|
143330 |
53191390 |
1 |
OSN2C15H20 |
ABC2D15E20 |
-25.7 |
6.52 |
-8.2 |
-0.29 |
0 |
|
|
143331 |
53192272 |
1 |
N5C15H21 |
A5B15C21 |
76.33 |
2.32 |
-8.57 |
0.24 |
0 |
|
|
143332 |
53192556 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-23.86 |
7.76 |
-8.18 |
0.2 |
0 |
|
|
143333 |
53192714 |
1 |
ON6C16H24 |
AB6C16D24 |
15.01 |
3.68 |
-9.17 |
0.08 |
0 |