List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
233288 |
89649815 |
1 |
ClN2O5C25H25 |
AB2C5D25E25 |
-140.28 |
6.31 |
-8.84 |
-1.08 |
0 |
|
|
233289 |
89649816 |
1 |
ClON2C6H13 |
ABC2D6E13 |
-93.9 |
3.95 |
-9.41 |
1.01 |
0 |
|
|
233290 |
89649820 |
1 |
O2F3N4H21C22 |
A2B3C4D21E22 |
-181.74 |
5.03 |
-9.21 |
-1.17 |
0 |
|
|
233291 |
89649849 |
1 |
F2N3O3C22H23 |
A2B3C3D22E23 |
-202.14 |
2.87 |
-8.62 |
-0.33 |
0 |
|
|
233292 |
89649850 |
1 |
FON5H16C18 |
ABC5D16E18 |
6.61 |
7.21 |
-9.16 |
-1.1 |
0 |
|
|
233293 |
89649864 |
1 |
ClN2O5C26H27 |
AB2C5D26E27 |
-126.65 |
5.98 |
-8.92 |
-0.84 |
0 |
|
|
233294 |
89649867 |
1 |
ClN3O6C36H38 |
AB3C6D36E38 |
-196.95 |
5.93 |
-8.88 |
-1.36 |
0 |
|
|
233295 |
89649868 |
1 |
N9C18H19 |
A9B18C19 |
162.82 |
3.91 |
-8.45 |
-0.29 |
0 |
|
|
233296 |
89649872 |
1 |
ClFNOC4H5 |
ABCDE4F5 |
-82.09 |
3.16 |
-10.75 |
-0.14 |
0 |
|
|
233297 |
89649873 |
1 |
FOC11H13 |
ABC11D13 |
-76.69 |
4.94 |
-10.11 |
-0.82 |
0 |
|
|
233298 |
89649875 |
1 |
FO3N4C22H23 |
AB3C4D22E23 |
-126.31 |
4.03 |
-8.71 |
-0.59 |
0 |
|
|
233299 |
89649890 |
1 |
BrN2O3C20H21 |
AB2C3D20E21 |
-72.32 |
6.71 |
-8.65 |
-0.55 |
0 |
|
|
233300 |
89649891 |
1 |
BrO2N4C17H21 |
AB2C4D17E21 |
-29.57 |
1.22 |
-9.46 |
-1.06 |
0 |
|
|
233301 |
89649895 |
1 |
ClS2F3N6O6C24H26 |
AB2C3D6E6F24G26 |
-375.14 |
5.6 |
-8.94 |
-1.2 |
0 |
|
|
233302 |
89649898 |
1 |
FN2O2H9C12 |
AB2C2D9E12 |
-67.32 |
6.14 |
-9.96 |
-1.28 |
0 |
|
|
233303 |
89649910 |
1 |
O3N4C23H26 |
A3B4C23D26 |
-96.8 |
3.62 |
-8.7 |
-0.22 |
0 |
|
|
233304 |
89649915 |
1 |
FN4O4C25H29 |
AB4C4D25E29 |
-191.82 |
6.02 |
-8.76 |
-0.34 |
0 |
|
|
233305 |
89649918 |
1 |
O3N5C30H39 |
A3B5C30D39 |
-79.63 |
7.5 |
-8.99 |
-0.71 |
0 |
|
|
233306 |
89649921 |
1 |
OSN3F4H15C16 |
ABC3D4E15F16 |
-164.65 |
4.46 |
-8.89 |
-0.84 |
0 |
|
|
233307 |
89649924 |
1 |
FN4O4C20H21 |
AB4C4D20E21 |
-180.02 |
3.61 |
-8.82 |
-0.69 |
0 |
|
|
233308 |
89649928 |
1 |
NOF2C8H13 |
ABC2D8E13 |
-168.37 |
3.74 |
-10.25 |
0.77 |
0 |
|
|
233309 |
89649951 |
1 |
N2O6C7H16 |
A2B6C7D16 |
-284.34 |
5.79 |
-10.21 |
0.63 |
0 |
|
|
233310 |
89649952 |
1 |
ClS2N3O5F6H30C31 |
AB2C3D5E6F30G31 |
-443.07 |
5.25 |
-9.08 |
-1.21 |
0 |
|
|
233311 |
89649963 |
2 |
NO2C12H15 |
AB2C12D15 |
-86.31 |
4.72 |
-8.27 |
-0.77 |
0 |
|
|
233312 |
89649977 |
1 |
BrNO4C15H16 |
ABC4D15E16 |
-149.44 |
5.83 |
-10.27 |
-1.36 |
0 |
|
|
233313 |
89649987 |
2 |
ClOC4H4 |
ABC4D4 |
-66.37 |
2.8 |
-9.67 |
-0.89 |
0 |
|
|
233314 |
89649988 |
1 |
N3O4C20H27 |
A3B4C20D27 |
-126.71 |
4.14 |
-8.22 |
0.02 |
0 |
|
|
233315 |
89649991 |
1 |
ClFO4N5C28H33 |
ABC4D5E28F33 |
-166.14 |
7.27 |
-9.16 |
-1.08 |
0 |
|
|
233316 |
89649992 |
1 |
BrN2O4C38H53 |
AB2C4D38E53 |
-78.18 |
0.28 |
-10.21 |
-2.06 |
0 |
|
|
233317 |
89649994 |
1 |
OSCl2N2F6H6C10 |
ABC2D2E6F6G10 |
-315.85 |
4.55 |
-9.19 |
-1.21 |
0 |
|
|
233318 |
89649995 |
1 |
FN2O4C17H23 |
AB2C4D17E23 |
-222.94 |
6.12 |
-9.57 |
-0.81 |
0 |
|
|
233319 |
89649998 |
1 |
SN2O3C8H16 |
AB2C3D8E16 |
-152.98 |
2.91 |
-9.51 |
-0.26 |
0 |
|
|
233320 |
89650001 |
2 |
N2O2C10H17 |
A2B2C10D17 |
-104.26 |
1.63 |
-8.8 |
0.03 |
0 |
|
|
233321 |
89650005 |
1 |
O3N4C15H16 |
A3B4C15D16 |
-84.15 |
3.04 |
-9.43 |
-0.92 |
0 |
|
|
233322 |
89650006 |
1 |
ON2C15H22 |
AB2C15D22 |
-45.18 |
1.53 |
-9.16 |
0.35 |
0 |
|
|
233323 |
89650012 |
1 |
O2N3H15C18 |
A2B3C15D18 |
-15.31 |
6.2 |
-8.19 |
-1.5 |
0 |
|
|
233324 |
89650024 |
1 |
ClN3O3H12C13 |
AB3C3D12E13 |
-11.13 |
8.65 |
-9.8 |
-2.08 |
0 |
|
|
233325 |
89650026 |
1 |
BrFNO2C13H13 |
ABCD2E13F13 |
-97.06 |
3.34 |
-9.69 |
-0.84 |
0 |
|
|
233326 |
89650029 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-129.35 |
2.02 |
-9.79 |
-0.7 |
0 |
|
|
233327 |
89650040 |
1 |
BrNO2H14C17 |
ABC2D14E17 |
-32.36 |
4.94 |
-8.81 |
-0.82 |
0 |
|
|
233328 |
89650041 |
1 |
FON4H17C25 |
ABC4D17E25 |
88.67 |
5.65 |
-9.05 |
-0.88 |
0 |
|
|
233329 |
89650050 |
1 |
ClSN4C13H21 |
ABC4D13E21 |
35.52 |
3.62 |
-8.79 |
-0.16 |
0 |
|
|
233330 |
89650052 |
1 |
NO2H7C10 |
AB2C7D10 |
71.45 |
3.35 |
-9.52 |
-1.26 |
0 |
|
|
233331 |
89650245 |
1 |
NO6C17H23 |
AB6C17D23 |
-255.51 |
7.14 |
-9.71 |
-0.72 |
0 |
|
|
233332 |
89850268 |
1 |
O2F9H23C24 |
A2B9C23D24 |
-543.57 |
7.61 |
-10.12 |
-1.12 |
0 |
|
|
233333 |
89850269 |
1 |
O2F9H21C23 |
A2B9C21D23 |
-515.68 |
7.45 |
-9.83 |
-1.25 |
0 |
|
|
233334 |
89850270 |
2 |
OF5C13H13 |
AB5C13D13 |
-599.51 |
9.64 |
-10.29 |
-1.15 |
0 |
|
|
233335 |
89850271 |
1 |
O2F11H23C25 |
A2B11C23D25 |
-640.76 |
10.01 |
-10.43 |
-1.42 |
0 |
|
|
233336 |
89850272 |
1 |
O3F9C27H29 |
A3B9C27D29 |
-595.25 |
8.15 |
-9.97 |
-1.02 |
0 |
|
|
233337 |
89850273 |
1 |
O3F11H23C25 |
A3B11C23D25 |
-674.75 |
9.25 |
-10.06 |
-1.47 |
0 |