List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
192232 |
78248177 |
2 |
NO2C12H13 |
AB2C12D13 |
-89.3 |
2.8 |
-8.69 |
-1.55 |
2 |
|
|
192233 |
78248178 |
1 |
FO2N4C18H23 |
AB2C4D18E23 |
-46.38 |
15.2 |
-6.25 |
-0.86 |
1 |
|
|
192234 |
78248179 |
1 |
FO2N4C18H22 |
AB2C4D18E22 |
-67.28 |
3.32 |
0.0 |
0.0 |
0 |
|
|
192235 |
78248180 |
1 |
ClNO4C28H30 |
ABC4D28E30 |
-125.99 |
1.92 |
-8.76 |
-1.04 |
2 |
|
|
192236 |
78248181 |
1 |
O4N6C15H16 |
A4B6C15D16 |
-65.45 |
2.79 |
-8.76 |
-1.03 |
0 |
|
|
192237 |
78248182 |
1 |
N2O4H22C23 |
A2B4C22D23 |
-89.59 |
3.23 |
-9.24 |
-1.06 |
-1 |
|
|
192238 |
78248183 |
1 |
ClSO2N4C21H22 |
ABC2D4E21F22 |
12.11 |
6.89 |
0.0 |
0.0 |
0 |
|
|
192239 |
78248184 |
1 |
N3O4C15H17 |
A3B4C15D17 |
-105.52 |
5.63 |
-8.8 |
-0.11 |
-1 |
|
|
192240 |
78248185 |
1 |
SN2O4H19C24 |
AB2C4D19E24 |
-13.41 |
8.23 |
0.0 |
0.0 |
1 |
|
|
192241 |
78248329 |
1 |
SN3O4C20H22 |
AB3C4D20E22 |
-120.71 |
2.85 |
0.0 |
0.0 |
1 |
|
|
192242 |
78248677 |
1 |
ClFSN2O2H19C23 |
ABCD2E2F19G23 |
-68.86 |
4.76 |
0.0 |
0.0 |
1 |
|
|
192243 |
78248782 |
1 |
O3N4C19H27 |
A3B4C19D27 |
-72.29 |
3.85 |
0.0 |
0.0 |
0 |
|
|
192244 |
78248783 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-80.09 |
2.73 |
-8.63 |
-0.05 |
1 |
|
|
192245 |
78248784 |
1 |
O2F3N3C25H29 |
A2B3C3D25E29 |
-162.84 |
8.83 |
0.0 |
0.0 |
1 |
|
|
192246 |
78248785 |
1 |
SO2N6H19C20 |
AB2C6D19E20 |
85.68 |
12.24 |
0.0 |
0.0 |
0 |
|
|
192247 |
78248786 |
1 |
SO2N6H18C20 |
AB2C6D18E20 |
64.38 |
5.84 |
-8.46 |
-0.94 |
0 |
|
|
192248 |
78248937 |
1 |
ClFNO3H15C17 |
ABCD3E15F17 |
-138.32 |
1.29 |
-9.93 |
-1.25 |
1 |
|
|
192249 |
78248938 |
1 |
O3N5C22H28 |
A3B5C22D28 |
-28.96 |
2.53 |
0.0 |
0.0 |
0 |
|
|
192250 |
78249304 |
1 |
N2O5C18H20 |
A2B5C18D20 |
-205.98 |
7.36 |
-10.16 |
-1.48 |
0 |
|
|
192251 |
78249797 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-43.69 |
1.26 |
-8.47 |
-0.38 |
0 |
|
|
192252 |
78250326 |
1 |
SN2O3C24H38 |
AB2C3D24E38 |
-141.73 |
6.49 |
-8.47 |
-0.73 |
0 |
|
|
192253 |
78250433 |
1 |
NSO3C18H25 |
ABC3D18E25 |
-118.82 |
2.91 |
-8.57 |
-0.84 |
0 |
|
|
192254 |
78250434 |
1 |
SN2O5H20C23 |
AB2C5D20E23 |
-54.83 |
5.73 |
-8.7 |
-1.6 |
0 |
|
|
192255 |
78250435 |
1 |
SO2N5C27H29 |
AB2C5D27E29 |
4.33 |
4.51 |
-9.1 |
-0.89 |
1 |
|
|
192256 |
78250436 |
1 |
O2S2N5C18H22 |
A2B2C5D18E22 |
-14.56 |
7.33 |
0.0 |
0.0 |
0 |
|
|
192257 |
78250437 |
1 |
Cl2O2N4H18C23 |
A2B2C4D18E23 |
53.7 |
6.04 |
-8.94 |
-0.92 |
-1 |
|
|
192258 |
78250438 |
1 |
N3O3S3H14C20 |
A3B3C3D14E20 |
58.47 |
5.91 |
0.0 |
0.0 |
0 |
|
|
192259 |
78250439 |
1 |
OS2N4C29H32 |
AB2C4D29E32 |
47.69 |
2.33 |
-8.68 |
-0.78 |
0 |
|
|
192260 |
78250440 |
1 |
NSO3C19H27 |
ABC3D19E27 |
-123.9 |
3.13 |
-8.56 |
-0.85 |
1 |
|
|
192261 |
78250441 |
1 |
SO2N4C20H29 |
AB2C4D20E29 |
-53.93 |
8.74 |
0.0 |
0.0 |
1 |
|
|
192262 |
78250442 |
1 |
OSN5C21H24 |
ABC5D21E24 |
69.83 |
4.65 |
0.0 |
0.0 |
0 |
|
|
192263 |
78250443 |
1 |
SO2N4C19H20 |
AB2C4D19E20 |
-7.35 |
4.98 |
-8.96 |
-0.46 |
0 |
|
|
192264 |
78250444 |
1 |
NOSH17C18 |
ABCD17E18 |
16.96 |
1.63 |
-8.14 |
-0.95 |
0 |
|
|
192265 |
78250445 |
1 |
ClN3O4H26C27 |
AB3C4D26E27 |
-100.96 |
4.74 |
-9.47 |
-1.54 |
0 |
|
|
192266 |
78250446 |
1 |
OSN4C27H30 |
ABC4D27E30 |
49.45 |
4.98 |
-8.55 |
-0.67 |
-1 |
|
|
192267 |
78250671 |
1 |
N2S2O6H13C18 |
A2B2C6D13E18 |
-25.54 |
8.25 |
0.0 |
0.0 |
0 |
|
|
192268 |
78250690 |
1 |
S2O3N4C26H32 |
A2B3C4D26E32 |
-64.22 |
1.85 |
-8.7 |
-0.86 |
1 |
|
|
192269 |
78250691 |
1 |
OS2N3C23H24 |
AB2C3D23E24 |
86.69 |
28.17 |
0.0 |
0.0 |
0 |
|
|
192270 |
78250752 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-25.63 |
7.23 |
-9.1 |
-1.45 |
1 |
|
|
192271 |
78250759 |
1 |
ClN2O2F3C21H25 |
AB2C2D3E21F25 |
-215.47 |
5.99 |
0.0 |
0.0 |
0 |
|
|
192272 |
78250843 |
1 |
OS2N4H24C25 |
AB2C4D24E25 |
66.47 |
1.79 |
-8.68 |
-0.84 |
0 |
|
|
192273 |
78250936 |
1 |
OSN2C23H34 |
ABC2D23E34 |
-66.53 |
3.16 |
-8.86 |
0.05 |
-1 |
|
|
192274 |
78251079 |
1 |
NO8C21H22 |
AB8C21D22 |
-215.45 |
7.74 |
0.0 |
0.0 |
0 |
|
|
192275 |
78251080 |
2 |
O2H9C10 |
A2B9C10 |
-110.1 |
4.81 |
-9.66 |
-1.12 |
-1 |
|
|
192276 |
78251915 |
1 |
S2N4O4H13C19 |
A2B4C4D13E19 |
-10.58 |
3.7 |
0.0 |
0.0 |
0 |
|
|
192277 |
78251970 |
1 |
ClSN2O3H21C25 |
ABC2D3E21F25 |
-45.83 |
6.31 |
-8.97 |
-1.56 |
0 |
|
|
192278 |
78252107 |
1 |
O2N3C24H29 |
A2B3C24D29 |
-10.07 |
4.27 |
-8.51 |
-0.29 |
0 |
|
|
192279 |
78252297 |
1 |
SN3O5C24H27 |
AB3C5D24E27 |
-121.92 |
7.7 |
-8.8 |
-1.41 |
1 |
|
|
192280 |
78252298 |
1 |
OF2N3H24C25 |
AB2C3D24E25 |
-14.74 |
9.25 |
0.0 |
0.0 |
2 |
|
|
192281 |
78252299 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-39.82 |
6.55 |
-8.38 |
-0.27 |
1 |