List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
420264 |
135112136 |
1 |
ClNO3C18H22 |
ABC3D18E22 |
-116.86 |
7.07 |
-9.06 |
-0.39 |
0 |
|
|
420265 |
135112140 |
1 |
N3O5C13H21 |
A3B5C13D21 |
-138.8 |
5.8 |
-9.99 |
-0.4 |
0 |
|
|
420266 |
135112141 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-59.58 |
6.21 |
-9.13 |
-1.09 |
0 |
|
|
420267 |
135112142 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-71.67 |
10.64 |
-9.27 |
-0.16 |
0 |
|
|
420268 |
135112143 |
1 |
N5C16H21 |
A5B16C21 |
73.05 |
6.34 |
-8.84 |
-0.53 |
0 |
|
|
420269 |
135112163 |
1 |
F3N6O7C37H47 |
A3B6C7D37E47 |
-452.64 |
13.16 |
-9.06 |
-0.27 |
0 |
|
|
420270 |
135112164 |
1 |
NF2O3C17H21 |
AB2C3D17E21 |
-233.9 |
6.12 |
-9.58 |
-0.48 |
0 |
|
|
420271 |
135112165 |
1 |
N4O4C21H28 |
A4B4C21D28 |
-167.47 |
6.04 |
-9.01 |
-0.09 |
0 |
|
|
420272 |
135112166 |
1 |
NO5C18H25 |
AB5C18D25 |
-215.49 |
5.17 |
-9.57 |
0.14 |
0 |
|
|
420273 |
135112175 |
1 |
N5O5C31H39 |
A5B5C31D39 |
-183.86 |
4.91 |
-9.34 |
-0.25 |
0 |
|
|
420274 |
135112180 |
1 |
O4N5C27H33 |
A4B5C27D33 |
-59.29 |
5.59 |
-8.76 |
-0.49 |
0 |
|
|
420275 |
135112182 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-90.3 |
2.84 |
-9.22 |
-0.81 |
0 |
|
|
420276 |
135112194 |
1 |
OSN2C21H24 |
ABC2D21E24 |
13.47 |
6.08 |
-8.15 |
-0.8 |
0 |
|
|
420277 |
135112212 |
5 |
NOC7H9 |
ABC7D9 |
-193.49 |
5.24 |
-8.44 |
-0.27 |
0 |
|
|
420278 |
135112215 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-101.49 |
5.31 |
-8.56 |
-0.4 |
0 |
|
|
420279 |
135112216 |
1 |
N2S2O5C15H22 |
A2B2C5D15E22 |
-165.25 |
2.37 |
-8.92 |
-1.22 |
0 |
|
|
420280 |
135112217 |
1 |
N2O3C18H32 |
A2B3C18D32 |
-156.66 |
2.86 |
-8.78 |
1.08 |
0 |
|
|
420281 |
135112218 |
1 |
FN3O4C21H28 |
AB3C4D21E28 |
-140.72 |
5.93 |
-9.08 |
-0.91 |
0 |
|
|
420282 |
135112231 |
1 |
SN2O2C19H22 |
AB2C2D19E22 |
-50.22 |
6.06 |
-8.4 |
-0.37 |
0 |
|
|
420283 |
135112232 |
1 |
ClON2C17H25 |
ABC2D17E25 |
-43.29 |
3.12 |
-8.71 |
-0.14 |
0 |
|
|
420284 |
135112243 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-23.55 |
5.65 |
-9.23 |
-0.57 |
0 |
|
|
420285 |
135112251 |
2 |
NO2C9H13 |
AB2C9D13 |
-144.99 |
6.3 |
-8.82 |
0.07 |
0 |
|
|
420286 |
135112254 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-43.56 |
8.64 |
-8.88 |
-0.21 |
0 |
|
|
420287 |
135112255 |
3 |
ON2C6H8 |
AB2C6D8 |
-54.2 |
6.17 |
-9.09 |
-0.82 |
0 |
|
|
420288 |
135112258 |
1 |
NSCl2O5C16H21 |
ABC2D5E16F21 |
-234.66 |
4.24 |
-9.9 |
-1.37 |
0 |
|
|
420289 |
135112268 |
1 |
SO4N7C28H35 |
AB4C7D28E35 |
-71.87 |
4.79 |
-8.8 |
-0.82 |
0 |
|
|
420290 |
135112269 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-109.52 |
4.7 |
-9.14 |
-0.52 |
0 |
|
|
420291 |
135112273 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-88.54 |
4.89 |
-8.34 |
-0.01 |
0 |
|
|
420292 |
135112278 |
1 |
FN3O3C16H20 |
AB3C3D16E20 |
-109.16 |
4.85 |
-9.5 |
-0.58 |
0 |
|
|
420293 |
135112280 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-36.61 |
3.44 |
-8.64 |
-0.05 |
0 |
|
|
420294 |
135112291 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-75.95 |
1.66 |
-8.98 |
-0.21 |
0 |
|
|
420295 |
135112293 |
1 |
OS2N4C16H16 |
AB2C4D16E16 |
56.42 |
5.33 |
-9.32 |
-1.39 |
0 |
|
|
420296 |
135112294 |
1 |
ClN3O3C16H22 |
AB3C3D16E22 |
-122.88 |
4.64 |
-9.15 |
-0.1 |
0 |
|
|
420297 |
135112295 |
1 |
O3N4C21H30 |
A3B4C21D30 |
-116.96 |
3.33 |
-8.71 |
-0.24 |
0 |
|
|
420298 |
135112296 |
3 |
N2C7H8 |
A2B7C8 |
96.79 |
4.03 |
-8.65 |
-0.58 |
0 |
|
|
420299 |
135112322 |
1 |
O2N5C13H17 |
A2B5C13D17 |
-25.19 |
1.5 |
-9.33 |
-0.09 |
0 |
|
|
420300 |
135112323 |
1 |
ClNO5C19H24 |
ABC5D19E24 |
-199.38 |
4.34 |
-9.5 |
-0.57 |
0 |
|
|
420301 |
135112331 |
1 |
SN3O4C18H21 |
AB3C4D18E21 |
-106.06 |
7.68 |
-9.51 |
-1.02 |
0 |
|
|
420302 |
135112340 |
1 |
SN5O5C28H35 |
AB5C5D28E35 |
-163.96 |
9.3 |
-8.4 |
-0.62 |
0 |
|
|
420303 |
135112351 |
1 |
FO2N3C18H20 |
AB2C3D18E20 |
-69.11 |
5.4 |
-8.49 |
-0.14 |
0 |
|
|
420304 |
135112360 |
1 |
SN3O3C11H19 |
AB3C3D11E19 |
-73.43 |
0.79 |
-8.86 |
-0.55 |
0 |
|
|
420305 |
135112368 |
1 |
FO2N4C18H25 |
AB2C4D18E25 |
-104.33 |
6.01 |
-9.14 |
-0.85 |
0 |
|
|
420306 |
135112370 |
1 |
FN3O5C18H20 |
AB3C5D18E20 |
-185.19 |
5.21 |
-9.33 |
-1.47 |
0 |
|
|
420307 |
135112372 |
1 |
O2N3C23H27 |
A2B3C23D27 |
-25.58 |
7.81 |
-8.75 |
-0.62 |
0 |
|
|
420309 |
135112374 |
1 |
NSF2O5C16H21 |
ABC2D5E16F21 |
-302.3 |
6.03 |
-9.69 |
-1.03 |
0 |
|
|
420310 |
135112384 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-128.83 |
2.93 |
-9.0 |
-0.16 |
0 |
|
|
420311 |
135112385 |
1 |
ON4C13H18 |
AB4C13D18 |
19.13 |
5.54 |
-9.2 |
-0.4 |
0 |
|
|
420312 |
135112386 |
1 |
SO2N5C18H23 |
AB2C5D18E23 |
-1.26 |
3.49 |
-8.31 |
-0.71 |
0 |
|
|
420313 |
135112400 |
1 |
ON3C14H19 |
AB3C14D19 |
11.95 |
2.44 |
-9.14 |
-0.12 |
0 |
|
|
420315 |
135112402 |
1 |
O4N5C28H35 |
A4B5C28D35 |
-85.0 |
4.14 |
-8.49 |
-0.08 |
0 |
|
|
420316 |
135112403 |
1 |
N2O3C18H20 |
A2B3C18D20 |
-88.08 |
6.21 |
-8.53 |
-0.53 |
0 |
|
|
420317 |
135112432 |
1 |
NO3C20H29 |
AB3C20D29 |
-133.25 |
2.6 |
-8.68 |
0.24 |
0 |
|
|
420318 |
135112433 |
1 |
FO2N4C17H21 |
AB2C4D17E21 |
-74.5 |
5.82 |
-8.83 |
0.0 |
0 |
|
|
420319 |
135112446 |
2 |
ON2C6H11 |
AB2C6D11 |
-87.08 |
4.61 |
-9.45 |
0.33 |
0 |
|
|
420321 |
135112480 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-5.02 |
6.42 |
-9.45 |
-0.15 |
0 |
|
|
420322 |
135112483 |
2 |
N3O4C19H24 |
A3B4C19D24 |
-307.77 |
4.01 |
-8.93 |
-0.27 |
0 |
|
|
420323 |
135112487 |
1 |
FON4C22H23 |
ABC4D22E23 |
-4.03 |
3.89 |
-8.72 |
-0.62 |
0 |
|
|
420324 |
135112488 |
3 |
NOC6H9 |
ABC6D9 |
-115.99 |
1.8 |
-8.97 |
-0.28 |
0 |
|
|
420325 |
135112490 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-54.28 |
1.81 |
-8.83 |
-0.5 |
0 |
|
|
420326 |
135112491 |
1 |
ON4C19H22 |
AB4C19D22 |
20.98 |
4.14 |
-8.44 |
-0.08 |
0 |
|
|
420327 |
135112492 |
1 |
NO5C20H31 |
AB5C20D31 |
-236.46 |
8.56 |
-8.97 |
-0.01 |
0 |
|
|
420329 |
135112517 |
1 |
ClNSO5C16H22 |
ABCD5E16F22 |
-223.97 |
2.8 |
-10.14 |
-1.13 |
0 |
|
|
420330 |
135112518 |
1 |
N2S2O3C14H22 |
A2B2C3D14E22 |
-91.17 |
6.34 |
-8.51 |
-0.91 |
0 |
|
|
420331 |
135112519 |
1 |
N3O5C18H23 |
A3B5C18D23 |
-136.55 |
2.12 |
-8.72 |
-1.0 |
0 |
|
|
420332 |
135112520 |
1 |
NO3C19H29 |
AB3C19D29 |
-138.72 |
2.73 |
-8.68 |
0.42 |
0 |
|
|
420333 |
135112553 |
1 |
NSO4C13H23 |
ABC4D13E23 |
-206.34 |
4.35 |
-9.52 |
0.8 |
0 |
|
|
420334 |
135112555 |
1 |
NO2C23H35 |
AB2C23D35 |
-115.57 |
5.1 |
-8.96 |
0.56 |
0 |
|
|
420335 |
135112556 |
1 |
O3N4C26H28 |
A3B4C26D28 |
-53.53 |
6.36 |
-9.12 |
-0.73 |
0 |
|
|
420336 |
135112566 |
1 |
ClFN4C17H24 |
ABC4D17E24 |
-14.82 |
4.49 |
-8.59 |
-0.14 |
0 |
|
|
420337 |
135112586 |
1 |
SO2N4C25H28 |
AB2C4D25E28 |
4.33 |
8.16 |
-9.16 |
-0.37 |
0 |
|
|
420338 |
135112587 |
1 |
N6O7C32H50 |
A6B7C32D50 |
-320.05 |
6.26 |
-9.41 |
0.01 |
0 |
|
|
420339 |
135112597 |
4 |
NC4H7 |
AB4C7 |
15.18 |
3.14 |
-8.64 |
0.79 |
0 |
|
|
420340 |
135112605 |
1 |
O7N8C43H54 |
A7B8C43D54 |
-238.55 |
7.85 |
-8.41 |
-0.87 |
0 |
|
|
420343 |
135112622 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-124.59 |
3.46 |
-9.49 |
-0.07 |
0 |
|
|
420344 |
135112624 |
1 |
SO2N3C22H23 |
AB2C3D22E23 |
4.73 |
6.88 |
-9.09 |
-0.35 |
0 |