List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
33237 |
7885568 |
1 |
NO4C21H25 |
AB4C21D25 |
-144.76 |
7.09 |
-9.2 |
-0.28 |
0 |
|
|
33238 |
7885570 |
1 |
SN4O4H16C17 |
AB4C4D16E17 |
-40.42 |
7.17 |
-9.09 |
-1.35 |
0 |
|
|
33239 |
7885577 |
1 |
NO5C23H27 |
AB5C23D27 |
-181.75 |
7.59 |
-9.21 |
-0.53 |
0 |
|
|
33240 |
7885587 |
1 |
SN3O3C16H21 |
AB3C3D16E21 |
-114.27 |
2.87 |
-8.94 |
-1.17 |
0 |
|
|
33241 |
7885605 |
1 |
SN3O4H15C17 |
AB3C4D15E17 |
-33.1 |
6.03 |
-8.83 |
-1.65 |
0 |
|
|
33242 |
7885608 |
1 |
N2O5C22H32 |
A2B5C22D32 |
-227.09 |
1.88 |
-9.17 |
-0.28 |
0 |
|
|
33243 |
7885610 |
1 |
NF2O5C21H21 |
AB2C5D21E21 |
-255.52 |
7.12 |
-9.24 |
-0.9 |
0 |
|
|
33244 |
7885611 |
1 |
OS2N3H13C16 |
AB2C3D13E16 |
37.15 |
1.64 |
-8.79 |
-1.06 |
0 |
|
|
33245 |
7885617 |
1 |
NO7C21H25 |
AB7C21D25 |
-262.1 |
8.76 |
-9.28 |
-0.37 |
0 |
|
|
33246 |
7885629 |
1 |
SO2N3C16H23 |
AB2C3D16E23 |
-86.77 |
3.94 |
-8.79 |
-1.0 |
0 |
|
|
33247 |
7885632 |
1 |
N2O5C21H30 |
A2B5C21D30 |
-228.28 |
4.4 |
-9.45 |
-0.46 |
0 |
|
|
33248 |
7885639 |
1 |
SN2O2C19H20 |
AB2C2D19E20 |
-49.16 |
4.52 |
-8.63 |
-0.83 |
0 |
|
|
33249 |
7885640 |
1 |
N3O6C18H25 |
A3B6C18D25 |
-249.28 |
8.71 |
-9.09 |
-0.11 |
0 |
|
|
33250 |
7885645 |
1 |
SN3O4C17H21 |
AB3C4D17E21 |
-155.29 |
4.11 |
-8.88 |
-1.1 |
0 |
|
|
33251 |
7885651 |
1 |
SO3N4C17H22 |
AB3C4D17E22 |
-121.77 |
5.57 |
-8.68 |
-0.9 |
0 |
|
|
33252 |
7885659 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-28.96 |
7.06 |
-8.47 |
-0.64 |
0 |
|
|
33253 |
7885663 |
1 |
SO2N3H19C20 |
AB2C3D19E20 |
-20.47 |
6.41 |
-8.61 |
-0.8 |
0 |
|
|
33254 |
7885664 |
1 |
N3O6C19H27 |
A3B6C19D27 |
-257.46 |
6.51 |
-9.29 |
-0.22 |
0 |
|
|
33255 |
7885665 |
1 |
SN2O3C14H18 |
AB2C3D14E18 |
-123.01 |
2.31 |
-8.82 |
-1.03 |
0 |
|
|
33256 |
7885669 |
1 |
N2O5C24H28 |
A2B5C24D28 |
-177.56 |
4.67 |
-8.64 |
-0.24 |
0 |
|
|
33257 |
7885682 |
1 |
FSN2O2H15C16 |
ABC2D2E15F16 |
-74.37 |
0.94 |
-8.75 |
-0.98 |
0 |
|
|
33258 |
7885689 |
1 |
FNO4C20H22 |
ABC4D20E22 |
-183.42 |
4.88 |
-9.26 |
-0.42 |
0 |
|
|
33259 |
7885690 |
1 |
SO3N4C18H18 |
AB3C4D18E18 |
-78.82 |
2.49 |
-9.04 |
-1.34 |
0 |
|
|
33260 |
7885695 |
1 |
NO6C22H25 |
AB6C22D25 |
-219.06 |
8.63 |
-9.26 |
-0.84 |
0 |
|
|
33261 |
7885701 |
1 |
NO5C19H25 |
AB5C19D25 |
-207.75 |
7.28 |
-9.4 |
-0.47 |
0 |
|
|
33262 |
7885710 |
1 |
N2O5C22H32 |
A2B5C22D32 |
-219.12 |
9.2 |
-9.14 |
-0.17 |
0 |
|
|
33263 |
7885714 |
1 |
SN3O3C20H23 |
AB3C3D20E23 |
-79.11 |
4.14 |
-8.64 |
-0.82 |
0 |
|
|
33264 |
7885716 |
1 |
BrOSN2H13C15 |
ABCD2E13F15 |
10.6 |
1.65 |
-8.75 |
-0.97 |
0 |
|
|
33265 |
7885717 |
1 |
ClN2O5C21H23 |
AB2C5D21E23 |
-183.14 |
4.79 |
-9.06 |
-0.5 |
0 |
|
|
33266 |
7885732 |
1 |
N2O5C23H28 |
A2B5C23D28 |
-197.53 |
6.6 |
-8.79 |
-0.56 |
0 |
|
|
33267 |
7885738 |
1 |
N2O5C24H28 |
A2B5C24D28 |
-176.94 |
3.59 |
-8.87 |
-0.2 |
0 |
|
|
33268 |
7885739 |
1 |
ClN2O5C21H23 |
AB2C5D21E23 |
-180.89 |
4.18 |
-9.07 |
-0.44 |
0 |
|
|
33269 |
7885741 |
1 |
SN3O3C19H21 |
AB3C3D19E21 |
-74.02 |
5.07 |
-8.63 |
-0.8 |
0 |
|
|
33270 |
7885742 |
1 |
N2O5C23H34 |
A2B5C23D34 |
-234.06 |
6.46 |
-9.33 |
-0.38 |
0 |
|
|
33271 |
7885760 |
1 |
ClN2O5C21H23 |
AB2C5D21E23 |
-181.1 |
7.08 |
-9.1 |
-0.48 |
0 |
|
|
33272 |
7885762 |
1 |
FN2O5C21H23 |
AB2C5D21E23 |
-217.98 |
4.63 |
-9.03 |
-0.38 |
0 |
|
|
33273 |
7885766 |
1 |
NSO5C19H21 |
ABC5D19E21 |
-159.89 |
3.82 |
-9.18 |
-1.16 |
0 |
|
|
33274 |
7885775 |
1 |
FSN2O3H15C17 |
ABC2D3E15F17 |
-103.9 |
4.12 |
-8.69 |
-1.11 |
0 |
|
|
33275 |
7885785 |
1 |
SN3O4C19H19 |
AB3C4D19E19 |
-105.57 |
2.32 |
-8.77 |
-0.98 |
0 |
|
|
33276 |
7885794 |
1 |
SN2O2C15H18 |
AB2C2D15E18 |
-56.06 |
3.41 |
-8.56 |
-0.9 |
0 |
|
|
33277 |
7885796 |
1 |
NSO4C21H25 |
ABC4D21E25 |
-136.86 |
2.7 |
-8.48 |
-0.21 |
0 |
|
|
33278 |
7885797 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-28.28 |
4.81 |
-8.51 |
-0.84 |
0 |
|
|
33279 |
7885801 |
1 |
N3O5C22H23 |
A3B5C22D23 |
-100.04 |
4.11 |
-9.16 |
-0.92 |
0 |
|
|
33280 |
7885805 |
1 |
S2O3N4C19H22 |
A2B3C4D19E22 |
-71.28 |
1.78 |
-8.79 |
-1.24 |
0 |
|
|
33281 |
7885806 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-67.49 |
4.11 |
-8.69 |
-1.05 |
0 |
|
|
33282 |
7885813 |
2 |
OSN2C9H10 |
ABC2D9E10 |
-17.32 |
4.85 |
-8.99 |
-1.58 |
0 |
|
|
33283 |
7885819 |
1 |
SO2N3H21C24 |
AB2C3D21E24 |
8.28 |
3.82 |
-8.87 |
-1.27 |
0 |
|
|
33284 |
7885831 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-62.26 |
3.78 |
-8.67 |
-1.02 |
0 |
|
|
33285 |
7885833 |
2 |
NSO2C10H10 |
ABC2D10E10 |
-88.46 |
2.33 |
-8.64 |
-1.08 |
0 |
|
|
33286 |
7885834 |
1 |
ClSO2N3H16C18 |
ABC2D3E16F18 |
-36.36 |
3.75 |
-9.0 |
-1.41 |
0 |
|
|
33287 |
7885835 |
1 |
O2S2N3C21H27 |
A2B2C3D21E27 |
-62.78 |
4.2 |
-8.49 |
-0.88 |
0 |
|
|
33288 |
7885836 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
-36.17 |
3.77 |
-8.58 |
-1.28 |
0 |
|
|
33289 |
7885843 |
1 |
SN3O3H17C18 |
AB3C3D17E18 |
-59.87 |
4.92 |
-8.75 |
-1.35 |
0 |
|
|
33290 |
7885850 |
1 |
SO2N4H14C18 |
AB2C4D14E18 |
14.81 |
0.31 |
-8.87 |
-1.32 |
0 |
|
|
33291 |
7885853 |
1 |
N2O2S2C19H22 |
A2B2C2D19E22 |
-51.71 |
3.56 |
-8.63 |
-1.19 |
0 |
|
|
33292 |
7885858 |
1 |
ClSO2N3H16C18 |
ABC2D3E16F18 |
-29.46 |
4.7 |
-8.94 |
-1.33 |
0 |
|
|
33293 |
7885863 |
1 |
S2O3N4H16C18 |
A2B3C4D16E18 |
14.7 |
3.79 |
-8.72 |
-1.33 |
0 |
|
|
33294 |
7885864 |
1 |
SN3O3C19H19 |
AB3C3D19E19 |
-62.78 |
4.97 |
-8.5 |
-1.21 |
0 |
|
|
33295 |
7885868 |
1 |
FN2S2O3H19C20 |
AB2C2D3E19F20 |
-96.32 |
5.62 |
-8.54 |
-0.99 |
0 |
|
|
33296 |
7885869 |
1 |
SO2N3C23H25 |
AB2C3D23E25 |
-34.64 |
3.59 |
-8.7 |
-1.06 |
0 |
|
|
33297 |
7885870 |
1 |
SO2N3C14H15 |
AB2C3D14E15 |
-27.26 |
3.53 |
-8.88 |
-1.27 |
0 |
|
|
33298 |
7885872 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-40.97 |
3.58 |
-8.92 |
-1.31 |
0 |
|
|
33299 |
7885874 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-35.35 |
4.17 |
-8.78 |
-1.33 |
0 |
|
|
33300 |
7885877 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
-36.16 |
3.38 |
-8.63 |
-1.32 |
0 |
|
|
33301 |
7885878 |
1 |
ClNSO2F3C19H23 |
ABCD2E3F19G23 |
-253.28 |
4.9 |
-10.03 |
-1.37 |
0 |
|
|
33302 |
7885882 |
1 |
O2S2N3C21H23 |
A2B2C3D21E23 |
-32.76 |
2.88 |
-8.7 |
-1.08 |
0 |
|
|
33303 |
7885885 |
1 |
O2N3S3H17C19 |
A2B3C3D17E19 |
26.14 |
2.73 |
-8.6 |
-1.11 |
0 |
|
|
33304 |
7885886 |
1 |
SN4O5H18C19 |
AB4C5D18E19 |
-72.07 |
9.49 |
-9.18 |
-1.61 |
0 |
|
|
33305 |
7885887 |
1 |
S2O3N4C16H18 |
A2B3C4D16E18 |
-79.77 |
5.71 |
-8.47 |
-0.84 |
0 |
|
|
33306 |
7885889 |
1 |
OS2N3H17C19 |
AB2C3D17E19 |
53.19 |
3.65 |
-8.69 |
-1.06 |
0 |
|
|
33307 |
7885890 |
1 |
FN2O2S2C19H19 |
AB2C2D2E19F19 |
-65.1 |
3.74 |
-8.52 |
-0.88 |
0 |
|
|
33308 |
7885891 |
1 |
ClSO2N3H14C17 |
ABC2D3E14F17 |
-27.69 |
4.69 |
-8.96 |
-1.41 |
0 |
|
|
33309 |
7885894 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-38.12 |
3.64 |
-8.78 |
-1.15 |
0 |
|
|
33310 |
7885895 |
1 |
S2O3N4C19H24 |
A2B3C4D19E24 |
-88.96 |
5.29 |
-8.66 |
-1.18 |
0 |
|
|
33311 |
7885898 |
1 |
S2N3O3C17H23 |
A2B3C3D17E23 |
-95.01 |
5.04 |
-8.62 |
-1.0 |
0 |
|
|
33312 |
7885899 |
1 |
SN3O4H17C19 |
AB3C4D17E19 |
-102.93 |
2.85 |
-8.72 |
-1.09 |
0 |
|
|
33313 |
7885902 |
1 |
N2S2O4H18C19 |
A2B2C4D18E19 |
-92.95 |
1.77 |
-8.69 |
-1.16 |
0 |
|
|
33314 |
7885905 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-68.85 |
3.7 |
-8.81 |
-1.2 |
0 |
|
|
33315 |
7885930 |
1 |
SN4O4H18C19 |
AB4C4D18E19 |
-41.8 |
3.12 |
-8.8 |
-1.33 |
0 |
|
|
33316 |
7885945 |
1 |
O2S2N3H19C21 |
A2B2C3D19E21 |
22.79 |
2.62 |
-8.64 |
-1.04 |
0 |
|
|
33317 |
7885946 |
1 |
SN3O3C17H21 |
AB3C3D17E21 |
-100.05 |
2.77 |
-8.83 |
-1.2 |
0 |
|
|
33318 |
7885949 |
1 |
SN3O3C17H21 |
AB3C3D17E21 |
-100.27 |
2.48 |
-8.82 |
-1.18 |
1 |
|
|
33319 |
7885950 |
1 |
O2S2N4C20H29 |
A2B2C4D20E29 |
-21.9 |
4.44 |
0.0 |
0.0 |
0 |
|
|
33320 |
7885952 |
1 |
FN2O2S2H19C20 |
AB2C2D2E19F20 |
-64.32 |
2.26 |
-8.72 |
-1.08 |
0 |
|
|
33321 |
7885960 |
2 |
OSN2C10H13 |
ABC2D10E13 |
-43.76 |
5.11 |
-8.91 |
-1.28 |
0 |
|
|
33322 |
7885969 |
1 |
SN2O2H18C19 |
AB2C2D18E19 |
-20.29 |
4.63 |
-8.54 |
-0.89 |
0 |
|
|
33323 |
7885970 |
1 |
N2O2S2C17H20 |
A2B2C2D17E20 |
-52.72 |
3.68 |
-8.59 |
-0.98 |
0 |
|
|
33324 |
7885972 |
1 |
N2S2O3C15H18 |
A2B2C3D15E18 |
-93.53 |
2.29 |
-8.65 |
-1.01 |
0 |
|
|
33325 |
7885974 |
1 |
SO2N3C15H15 |
AB2C3D15E15 |
1.21 |
2.73 |
-8.74 |
-1.11 |
0 |
|
|
33326 |
7885975 |
2 |
OSN2H9C10 |
ABC2D9E10 |
13.77 |
1.88 |
-8.67 |
-1.03 |
0 |
|
|
33327 |
7885976 |
1 |
SN3O4H15C18 |
AB3C4D15E18 |
-19.7 |
3.18 |
-8.73 |
-1.64 |
0 |
|
|
33328 |
7885982 |
1 |
S2N3O3C19H21 |
A2B3C3D19E21 |
-49.31 |
3.96 |
-8.58 |
-0.95 |
0 |
|
|
33329 |
7885983 |
1 |
SN3O4C19H19 |
AB3C4D19E19 |
-96.59 |
3.73 |
-8.47 |
-0.99 |
0 |
|
|
33330 |
7885984 |
2 |
OSN2H9C10 |
ABC2D9E10 |
14.76 |
6.24 |
-8.91 |
-1.31 |
0 |
|
|
33331 |
7885986 |
1 |
S2O3N4C18H24 |
A2B3C4D18E24 |
-109.96 |
1.35 |
-8.79 |
-1.18 |
0 |
|
|
33332 |
7885988 |
1 |
S2O3N4C18H24 |
A2B3C4D18E24 |
-110.02 |
1.45 |
-8.76 |
-1.19 |
0 |
|
|
33333 |
7885995 |
1 |
O2S2N5C19H23 |
A2B2C5D19E23 |
-10.65 |
4.77 |
-8.88 |
-1.27 |
0 |
|
|
33334 |
7885997 |
2 |
OSN2H9C10 |
ABC2D9E10 |
56.14 |
1.2 |
-8.76 |
-1.19 |
0 |
|
|
33335 |
7885998 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-63.57 |
3.5 |
-8.83 |
-1.22 |
0 |
|
|
33336 |
7886000 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-69.38 |
3.67 |
-8.83 |
-1.22 |
0 |