List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
240301 |
93576856 |
1 |
SN2O2C11H16 |
AB2C2D11E16 |
-76.49 |
3.85 |
-8.37 |
-0.36 |
0 |
|
|
240302 |
93576858 |
1 |
SO2N3C10H15 |
AB2C3D10E15 |
-70.64 |
2.36 |
-8.28 |
-0.47 |
0 |
|
|
240303 |
93576860 |
1 |
OSN2C12H18 |
ABC2D12E18 |
-40.05 |
2.12 |
-8.34 |
-0.5 |
0 |
|
|
240304 |
93576874 |
1 |
OSN2C10H14 |
ABC2D10E14 |
-30.72 |
2.21 |
-8.26 |
-0.44 |
0 |
|
|
240305 |
93576884 |
1 |
ClON3H22C24 |
ABC3D22E24 |
31.29 |
4.02 |
-9.21 |
-0.44 |
0 |
|
|
240306 |
93576886 |
1 |
ClO2N3C21H22 |
AB2C3D21E22 |
-38.63 |
2.97 |
-9.23 |
-0.47 |
0 |
|
|
240307 |
93576891 |
1 |
O2N3C25H25 |
A2B3C25D25 |
2.05 |
5.37 |
-8.72 |
-0.21 |
0 |
|
|
240308 |
93576892 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-67.11 |
3.93 |
-8.61 |
-0.19 |
0 |
|
|
240309 |
93576895 |
1 |
N3O3C22H27 |
A3B3C22D27 |
-70.26 |
5.37 |
-8.2 |
-0.19 |
0 |
|
|
240310 |
93576898 |
1 |
N3O4C23H27 |
A3B4C23D27 |
-102.8 |
4.34 |
-8.19 |
-0.16 |
0 |
|
|
240311 |
93576899 |
1 |
N3O4C23H27 |
A3B4C23D27 |
-102.58 |
4.94 |
-8.2 |
-0.15 |
0 |
|
|
240312 |
93576900 |
1 |
ON3C19H21 |
AB3C19D21 |
12.64 |
3.08 |
-9.03 |
-0.56 |
0 |
|
|
240313 |
93576905 |
1 |
O2N3C20H21 |
A2B3C20D21 |
-17.82 |
3.7 |
-8.96 |
-0.44 |
0 |
|
|
240314 |
93576906 |
1 |
ON3C20H23 |
AB3C20D23 |
2.42 |
1.91 |
-9.09 |
-0.44 |
0 |
|
|
240315 |
93576907 |
1 |
ON3C20H23 |
AB3C20D23 |
1.54 |
1.64 |
-9.07 |
-0.46 |
0 |
|
|
240316 |
93576913 |
1 |
ClON3H20C23 |
ABC3D20E23 |
47.13 |
6.36 |
-8.87 |
-0.58 |
0 |
|
|
240317 |
93576916 |
1 |
ON3H23C24 |
AB3C23D24 |
41.33 |
3.07 |
-8.96 |
-0.5 |
0 |
|
|
240318 |
93576917 |
1 |
ON3H23C24 |
AB3C23D24 |
40.9 |
3.59 |
-8.94 |
-0.52 |
0 |
|
|
240319 |
93576919 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-29.62 |
1.84 |
-9.07 |
-0.49 |
0 |
|
|
240320 |
93576920 |
1 |
BrON3C19H20 |
ABC3D19E20 |
15.15 |
5.59 |
-9.18 |
-0.73 |
0 |
|
|
240321 |
93576921 |
1 |
BrON3C19H20 |
ABC3D19E20 |
15.1 |
4.87 |
-9.19 |
-0.81 |
0 |
|
|
240322 |
93576922 |
1 |
BrON3H20C23 |
ABC3D20E23 |
57.81 |
3.73 |
-9.06 |
-0.87 |
0 |
|
|
240323 |
93576923 |
1 |
BrON3H20C23 |
ABC3D20E23 |
53.62 |
3.15 |
-9.15 |
-0.87 |
0 |
|
|
240324 |
93576924 |
1 |
BrO2N3C20H20 |
AB2C3D20E20 |
-16.47 |
1.43 |
-9.25 |
-0.86 |
0 |
|
|
240325 |
93576926 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-27.97 |
4.06 |
-8.87 |
-0.61 |
0 |
|
|
240326 |
93576928 |
1 |
O2N3H23C24 |
A2B3C23D24 |
9.99 |
2.61 |
-9.0 |
-0.62 |
0 |
|
|
240327 |
93576934 |
1 |
N3O3C25H25 |
A3B3C25D25 |
-24.46 |
2.75 |
-8.36 |
-0.49 |
0 |
|
|
240328 |
93576948 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-27.82 |
3.6 |
-8.92 |
-0.32 |
0 |
|
|
240329 |
93576949 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-25.44 |
3.43 |
-8.82 |
-0.78 |
0 |
|
|
240330 |
93576950 |
1 |
ClON3C19H20 |
ABC3D19E20 |
2.8 |
4.11 |
-9.15 |
-0.81 |
0 |
|
|
240331 |
93576953 |
1 |
ClON3H20C23 |
ABC3D20E23 |
41.59 |
1.93 |
-9.14 |
-0.87 |
0 |
|
|
240332 |
93576958 |
1 |
OCl2N3H19C23 |
AB2C3D19E23 |
33.21 |
1.25 |
-9.16 |
-1.03 |
0 |
|
|
240333 |
93576959 |
1 |
OCl2N3H19C23 |
AB2C3D19E23 |
33.53 |
1.71 |
-9.13 |
-1.03 |
0 |
|
|
240334 |
93576961 |
1 |
Cl2O2N3H19C20 |
A2B2C3D19E20 |
-34.78 |
5.91 |
-9.12 |
-0.79 |
0 |
|
|
240335 |
93576966 |
1 |
BrO2N3C20H20 |
AB2C3D20E20 |
-17.68 |
2.83 |
-9.22 |
-0.9 |
0 |
|
|
240336 |
93576969 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-61.76 |
4.1 |
-8.94 |
-0.28 |
0 |
|
|
240337 |
93576970 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-60.81 |
5.16 |
-8.85 |
-0.13 |
0 |
|
|
240338 |
93576971 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-63.08 |
4.11 |
-8.93 |
-0.27 |
0 |
|
|
240339 |
93576972 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-64.52 |
4.22 |
-8.9 |
-0.22 |
0 |
|
|
240340 |
93576973 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-62.9 |
3.52 |
-8.93 |
-0.19 |
0 |
|
|
240341 |
93576974 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-63.83 |
4.61 |
-8.92 |
-0.24 |
0 |
|
|
240342 |
93577008 |
1 |
O2F3N3H18C20 |
A2B3C3D18E20 |
-177.37 |
5.65 |
-9.32 |
-0.69 |
0 |
|
|
240343 |
93577260 |
1 |
ClN2O2C19H21 |
AB2C2D19E21 |
-46.1 |
2.34 |
-8.74 |
-0.19 |
0 |
|
|
240344 |
93577401 |
1 |
ON2C24H24 |
AB2C24D24 |
31.57 |
2.68 |
-8.53 |
-0.02 |
0 |
|
|
240345 |
93577488 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-73.46 |
3.4 |
-8.69 |
-0.18 |
0 |
|
|
240346 |
93577818 |
1 |
ClO3N4H17C18 |
AB3C4D17E18 |
-57.61 |
7.39 |
-8.99 |
-1.13 |
0 |
|
|
240347 |
93577937 |
1 |
N2S2O5C26H36 |
A2B2C5D26E36 |
-205.81 |
7.37 |
-8.59 |
-0.39 |
0 |
|
|
240348 |
93577942 |
1 |
NSO4C21H27 |
ABC4D21E27 |
-134.88 |
6.02 |
-8.91 |
0.05 |
0 |
|
|
240349 |
93577943 |
1 |
NSO4C21H27 |
ABC4D21E27 |
-136.02 |
4.72 |
-9.03 |
0.08 |
0 |
|
|
240350 |
93577948 |
1 |
FNSO4C20H24 |
ABCD4E20F24 |
-173.42 |
4.99 |
-9.28 |
-0.35 |
0 |
|
|
240351 |
93577949 |
1 |
FNSO4C20H24 |
ABCD4E20F24 |
-171.28 |
4.17 |
-9.1 |
-0.43 |
0 |
|
|
240352 |
93577955 |
1 |
NSO4C24H33 |
ABC4D24E33 |
-150.28 |
7.41 |
-8.77 |
0.06 |
0 |
|
|
240353 |
93577956 |
1 |
NSO4C24H33 |
ABC4D24E33 |
-150.31 |
4.87 |
-9.07 |
0.08 |
0 |
|
|
240354 |
93577962 |
1 |
NSO4C24H27 |
ABC4D24E27 |
-106.22 |
5.04 |
-9.01 |
-0.78 |
0 |
|
|
240355 |
93577963 |
1 |
NSO5C19H25 |
ABC5D19E25 |
-165.96 |
8.08 |
-8.74 |
0.14 |
0 |
|
|
240356 |
93577968 |
1 |
NO6C24H33 |
AB6C24D33 |
-202.68 |
3.61 |
-8.73 |
0.06 |
0 |
|
|
240357 |
93577969 |
1 |
NO3C23H27 |
AB3C23D27 |
-58.45 |
2.38 |
-8.84 |
0.26 |
0 |
|
|
240358 |
93577975 |
1 |
N2O3C23H32 |
A2B3C23D32 |
-88.01 |
5.91 |
-8.12 |
0.33 |
0 |
|
|
240359 |
93577976 |
1 |
N2O3C23H32 |
A2B3C23D32 |
-87.48 |
5.28 |
-8.2 |
0.23 |
0 |
|
|
240360 |
93577979 |
1 |
NO3C22H25 |
AB3C22D25 |
-54.36 |
2.33 |
-8.84 |
0.27 |
0 |
|
|
240361 |
93577982 |
1 |
ClNO3C21H22 |
ABC3D21E22 |
-54.72 |
1.29 |
-8.94 |
-0.19 |
0 |
|
|
240362 |
93577983 |
1 |
ClNO3C21H22 |
ABC3D21E22 |
-53.74 |
2.26 |
-8.93 |
-0.03 |
0 |
|
|
240363 |
93577989 |
1 |
NO4C24H29 |
AB4C24D29 |
-96.54 |
3.55 |
-8.8 |
0.21 |
0 |
|
|
240364 |
93577990 |
1 |
NO4C24H29 |
AB4C24D29 |
-98.44 |
3.74 |
-8.86 |
0.2 |
0 |
|
|
240365 |
93577997 |
1 |
NO3C25H25 |
AB3C25D25 |
-30.08 |
2.61 |
-8.82 |
-0.56 |
0 |
|
|
240366 |
93577998 |
1 |
NO3C25H25 |
AB3C25D25 |
-28.99 |
1.52 |
-8.81 |
-0.45 |
0 |
|
|
240367 |
93578003 |
1 |
NSCl2O5C24H25 |
ABC2D5E24F25 |
-150.3 |
4.29 |
-9.02 |
-0.87 |
0 |
|
|
240368 |
93578004 |
1 |
NSCl2O5C24H25 |
ABC2D5E24F25 |
-151.77 |
4.23 |
-9.09 |
-0.94 |
0 |
|
|
240369 |
93578013 |
1 |
ClNSO5C24H26 |
ABCD5E24F26 |
-141.38 |
4.76 |
-8.91 |
-0.67 |
0 |
|
|
240370 |
93578014 |
1 |
ClNSO5C24H26 |
ABCD5E24F26 |
-142.28 |
6.63 |
-9.09 |
-0.91 |
0 |
|
|
240371 |
93578015 |
1 |
FNSO5C24H26 |
ABCD5E24F26 |
-180.18 |
4.31 |
-8.8 |
-0.59 |
0 |
|
|
240372 |
93578018 |
1 |
NO4C19H25 |
AB4C19D25 |
-119.07 |
2.6 |
-8.93 |
0.21 |
0 |
|
|
240373 |
93578019 |
1 |
NSO3C20H27 |
ABC3D20E27 |
-90.46 |
3.14 |
-8.75 |
0.02 |
0 |
|
|
240374 |
93578020 |
1 |
NSO3C20H27 |
ABC3D20E27 |
-92.09 |
3.27 |
-8.99 |
-0.18 |
0 |
|
|
240375 |
93578022 |
1 |
FNSO4C20H24 |
ABCD4E20F24 |
-170.04 |
6.37 |
-9.04 |
-0.52 |
0 |