List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
20239 |
582786 |
1 |
O4C25H38 |
A4B25C38 |
-232.11 |
9.21 |
-9.97 |
0.68 |
0 |
|
|
20240 |
582787 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-161.99 |
3.94 |
-8.4 |
-0.16 |
0 |
|
|
20241 |
582791 |
1 |
SN2O4C12H14 |
AB2C4D12E14 |
-129.73 |
6.64 |
-8.49 |
-0.14 |
0 |
|
|
20242 |
582792 |
1 |
NSeO2C12H13 |
ABC2D12E13 |
-49.94 |
5.55 |
-8.58 |
-0.55 |
0 |
|
|
20243 |
582794 |
1 |
N4O5H20C25 |
A4B5C20D25 |
-7.48 |
9.49 |
-8.62 |
-1.69 |
0 |
|
|
20244 |
582796 |
1 |
IO2H9C10 |
AB2C9D10 |
-32.09 |
1.05 |
-9.51 |
-1.12 |
0 |
|
|
20245 |
582801 |
3 |
NOC7H7 |
ABC7D7 |
-90.76 |
5.8 |
-9.02 |
-1.06 |
0 |
|
|
20246 |
582802 |
1 |
ON3H21C25 |
AB3C21D25 |
58.68 |
5.62 |
-8.28 |
-0.55 |
0 |
|
|
20247 |
582803 |
1 |
N2O3F7C20H21 |
A2B3C7D20E21 |
-466.33 |
4.79 |
-8.73 |
-0.4 |
0 |
|
|
20248 |
582804 |
1 |
NOSC5H9 |
ABCD5E9 |
-40.23 |
2.86 |
-9.22 |
-0.21 |
0 |
|
|
20249 |
582809 |
2 |
OC10H11 |
AB10C11 |
-73.05 |
1.03 |
-8.99 |
0.33 |
0 |
|
|
20250 |
582810 |
1 |
NOC15H19 |
ABC15D19 |
-29.45 |
2.51 |
-8.98 |
0.22 |
0 |
|
|
20251 |
582811 |
1 |
NOSC5H9 |
ABCD5E9 |
-39.0 |
3.48 |
-9.28 |
-0.28 |
0 |
|
|
20252 |
582813 |
1 |
F3O4C6H7 |
A3B4C6D7 |
-331.38 |
7.51 |
-11.2 |
-0.12 |
0 |
|
|
20253 |
582814 |
1 |
NOC11H11 |
ABC11D11 |
4.73 |
4.99 |
-8.91 |
-0.19 |
0 |
|
|
20254 |
582815 |
1 |
ON4H16C18 |
AB4C16D18 |
52.25 |
5.21 |
-8.3 |
-0.98 |
0 |
|
|
20255 |
582817 |
2 |
ClNO2C6H7 |
ABC2D6E7 |
-147.2 |
1.57 |
-9.4 |
-0.8 |
0 |
|
|
20256 |
582818 |
1 |
N2O4H14C17 |
A2B4C14D17 |
-8.17 |
7.06 |
-9.47 |
-1.26 |
0 |
|
|
20257 |
582819 |
1 |
O2C29H58 |
A2B29C58 |
-220.42 |
2.51 |
-10.51 |
0.88 |
0 |
|
|
20258 |
582820 |
1 |
NO5C11H19 |
AB5C11D19 |
-196.85 |
3.8 |
-10.06 |
0.66 |
0 |
|
|
20259 |
582821 |
1 |
SCl2H4C5 |
AB2C4D5 |
10.26 |
2.34 |
-9.5 |
-0.93 |
0 |
|
|
20260 |
582822 |
1 |
OH2C6F10 |
AB2C6D10 |
-518.11 |
0.39 |
-11.31 |
-1.09 |
0 |
|
|
20261 |
582823 |
1 |
SiC11H12 |
AB11C12 |
111.49 |
0.31 |
-9.58 |
-0.01 |
0 |
|
|
20262 |
582824 |
1 |
N2O5C11H16 |
A2B5C11D16 |
-225.9 |
3.18 |
-9.72 |
-0.55 |
0 |
|
|
20263 |
582827 |
1 |
SO2C9H14 |
AB2C9D14 |
-66.82 |
6.95 |
-10.6 |
-1.0 |
0 |
|
|
20264 |
582830 |
1 |
O7C32H42 |
A7B32C42 |
-321.09 |
6.09 |
-9.74 |
-0.99 |
0 |
|
|
20265 |
582838 |
1 |
N3F4O6H9C11 |
A3B4C6D9E11 |
-271.43 |
4.92 |
-11.11 |
-2.28 |
0 |
|
|
20266 |
582841 |
1 |
N3F4O4C7H7 |
A3B4C4D7E7 |
-257.27 |
6.36 |
-10.0 |
-1.04 |
0 |
|
|
20267 |
582842 |
2 |
ClC2F3 |
AB2C3 |
-290.97 |
0.78 |
-11.43 |
-1.13 |
0 |
|
|
20268 |
582844 |
1 |
Br2C3F6 |
A2B3C6 |
-305.2 |
1.55 |
-11.4 |
-2.2 |
0 |
|
|
20269 |
582861 |
1 |
NSiO4C30H53 |
ABC4D30E53 |
-310.21 |
1.38 |
-9.62 |
0.42 |
0 |
|
|
20270 |
582867 |
2 |
OSiC6H15 |
ABC6D15 |
-245.42 |
0.01 |
-9.68 |
1.4 |
0 |
|
|
20272 |
582880 |
1 |
SiO2C13H22 |
AB2C13D22 |
-138.91 |
0.35 |
-8.88 |
0.24 |
0 |
|
|
20273 |
582881 |
1 |
SiO2C24H40 |
AB2C24D40 |
-156.47 |
2.51 |
-9.44 |
-0.48 |
0 |
|
|
20274 |
582895 |
2 |
SN2H7C8 |
AB2C7D8 |
137.27 |
2.09 |
-9.32 |
-0.72 |
0 |
|
|
20275 |
582898 |
1 |
N3H5C7 |
A3B5C7 |
78.9 |
4.6 |
-10.06 |
-1.41 |
0 |
|
|
20276 |
582902 |
1 |
OC13H20 |
AB13C20 |
-29.63 |
1.38 |
-9.9 |
0.86 |
0 |
|
|
20277 |
582908 |
1 |
O5C9H16 |
A5B9C16 |
-243.12 |
2.98 |
-10.77 |
0.27 |
0 |
|
|
20278 |
582921 |
1 |
OC16H20 |
AB16C20 |
-25.57 |
3.27 |
-9.36 |
0.35 |
0 |
|
|
20279 |
582925 |
1 |
N2O2F5H13C17 |
A2B2C5D13E17 |
-209.23 |
3.29 |
-9.79 |
-1.42 |
0 |
|
|
20280 |
582927 |
1 |
C11H14 |
A11B14 |
57.41 |
1.34 |
-9.17 |
-0.37 |
0 |
|
|
20281 |
582928 |
1 |
BrC10H11 |
AB10C11 |
32.3 |
1.98 |
-9.45 |
0.08 |
0 |
|
|
20282 |
582929 |
1 |
C17H18 |
A17B18 |
45.18 |
0.96 |
-8.99 |
0.17 |
0 |
|
|
20283 |
582930 |
1 |
O4C13H16 |
A4B13C16 |
-170.87 |
5.01 |
-10.16 |
0.25 |
0 |
|
|
20284 |
582942 |
1 |
N2O3C18H20 |
A2B3C18D20 |
13.68 |
4.71 |
-8.66 |
-0.19 |
0 |
|
|
20285 |
582944 |
1 |
OC13H14 |
AB13C14 |
-3.17 |
2.99 |
-9.44 |
0.21 |
0 |
|
|
20286 |
582947 |
1 |
IC10H11 |
AB10C11 |
20.0 |
2.06 |
-9.25 |
-0.69 |
0 |
|
|
20287 |
582950 |
1 |
FN2O2H11C15 |
AB2C2D11E15 |
-35.96 |
0.94 |
-9.36 |
-1.0 |
0 |
|
|
20288 |
582954 |
1 |
NO3C5H9 |
AB3C5D9 |
-86.48 |
2.07 |
-9.96 |
0.08 |
0 |
|
|
20289 |
582957 |
1 |
O5C8H14 |
A5B8C14 |
-232.13 |
1.74 |
-10.76 |
0.24 |
0 |
|
|
20290 |
582958 |
1 |
SN2O4C13H16 |
AB2C4D13E16 |
-132.96 |
8.85 |
-9.36 |
0.01 |
0 |
|
|
20291 |
582959 |
1 |
N2O3C11H12 |
A2B3C11D12 |
-72.13 |
6.51 |
-8.88 |
-0.64 |
0 |
|
|
20292 |
582960 |
2 |
NOC5H5 |
ABC5D5 |
-23.3 |
5.11 |
-9.03 |
-0.63 |
0 |
|
|
20293 |
582964 |
1 |
OC13H16 |
AB13C16 |
-17.18 |
3.14 |
-9.46 |
-0.2 |
0 |
|
|
20294 |
582970 |
1 |
OH16C17 |
AB16C17 |
17.92 |
2.88 |
-9.41 |
-0.2 |
0 |
|
|
20295 |
582980 |
1 |
N2O3H12C15 |
A2B3C12D15 |
17.26 |
9.25 |
-9.41 |
-1.3 |
0 |
|
|
20296 |
582989 |
1 |
OC11H12 |
AB11C12 |
-6.54 |
3.02 |
-9.55 |
-0.17 |
0 |
|
|
20297 |
582990 |
1 |
O4H14C17 |
A4B14C17 |
-96.29 |
3.4 |
-9.67 |
-1.24 |
0 |
|
|
20298 |
582993 |
1 |
O3C17H22 |
A3B17C22 |
-111.63 |
3.34 |
-9.49 |
-0.71 |
0 |
|
|
20299 |
582999 |
1 |
ON2H12C16 |
AB2C12D16 |
52.04 |
2.26 |
-9.24 |
-1.03 |
0 |
|
|
20300 |
583006 |
1 |
NOC17H17 |
ABC17D17 |
85.88 |
2.67 |
-9.48 |
-0.03 |
0 |
|
|
20301 |
583016 |
1 |
OH16C17 |
AB16C17 |
43.84 |
1.91 |
-9.36 |
-0.29 |
0 |
|
|
20302 |
583017 |
1 |
NO3C12H15 |
AB3C12D15 |
-35.4 |
4.22 |
-9.66 |
-0.48 |
0 |
|
|
20303 |
583020 |
1 |
N2O2H7F9C12 |
A2B2C7D9E12 |
-490.89 |
6.74 |
-9.72 |
-1.03 |
0 |
|
|
20304 |
583023 |
1 |
N2F4O5H8C13 |
A2B4C5D8E13 |
-263.05 |
6.68 |
-10.08 |
-1.99 |
0 |
|
|
20305 |
583029 |
4 |
C3H4 |
A3B4 |
-6.48 |
1.05 |
-8.94 |
0.61 |
0 |
|
|
20306 |
583039 |
1 |
O3H12C16 |
A3B12C16 |
-45.87 |
2.89 |
-8.83 |
-0.66 |
0 |
|
|
20307 |
583040 |
1 |
OPSC12H25 |
ABCD12E25 |
-134.93 |
2.69 |
-9.07 |
0.12 |
0 |
|
|
20308 |
583046 |
1 |
O3C19H26 |
A3B19C26 |
-120.85 |
4.88 |
-9.71 |
0.01 |
0 |
|
|
20309 |
583051 |
1 |
NO2C10H11 |
AB2C10D11 |
-68.35 |
2.89 |
-8.82 |
-0.06 |
0 |
|
|
20310 |
583052 |
2 |
NC8H11 |
AB8C11 |
19.11 |
3.59 |
-8.77 |
0.4 |
0 |
|
|
20311 |
583056 |
1 |
NO3C11H13 |
AB3C11D13 |
-23.58 |
6.34 |
-9.21 |
-0.88 |
0 |
|
|
20312 |
583057 |
2 |
OH4C5 |
AB4C5 |
-7.8 |
0.01 |
-10.19 |
-0.04 |
0 |
|
|
20313 |
583058 |
1 |
O3C16H22 |
A3B16C22 |
-135.96 |
3.74 |
-9.65 |
0.09 |
0 |
|
|
20314 |
583059 |
4 |
C5H8 |
A5B8 |
-41.88 |
0.9 |
-8.98 |
0.56 |
0 |
|
|
20315 |
583063 |
2 |
OH4C5 |
AB4C5 |
-17.03 |
4.73 |
-10.08 |
-1.13 |
0 |
|
|
20316 |
583065 |
2 |
NC4H4 |
AB4C4 |
41.86 |
2.22 |
-8.4 |
0.12 |
0 |
|
|
20317 |
583067 |
4 |
NC2H2 |
AB2C2 |
94.89 |
2.66 |
-9.42 |
-0.66 |
0 |
|
|
20318 |
583075 |
1 |
C21H34 |
A21B34 |
-48.5 |
0.56 |
-8.74 |
0.6 |
0 |
|
|
20319 |
583081 |
4 |
OC7H11 |
AB7C11 |
-221.48 |
1.38 |
-9.14 |
0.76 |
0 |
|
|
20320 |
583084 |
1 |
O2C13H16 |
A2B13C16 |
-91.1 |
4.83 |
-9.26 |
0.23 |
0 |
|
|
20321 |
583085 |
1 |
OC10H10 |
AB10C10 |
-11.26 |
1.82 |
-8.47 |
-0.16 |
0 |
|
|
20322 |
583102 |
1 |
NOC21H21 |
ABC21D21 |
17.41 |
2.82 |
-8.4 |
-0.62 |
0 |
|
|
20323 |
583107 |
1 |
O2H10C11 |
A2B10C11 |
-41.45 |
5.02 |
-9.87 |
-0.63 |
0 |
|
|
20324 |
583113 |
1 |
O3C10H10 |
A3B10C10 |
-105.0 |
2.83 |
-9.51 |
-0.31 |
0 |
|
|
20325 |
583118 |
1 |
ON2C11H12 |
AB2C11D12 |
4.01 |
2.28 |
-9.16 |
-0.1 |
0 |
|
|
20326 |
583128 |
1 |
NC5O5H9 |
AB5C5D9 |
-173.71 |
4.71 |
-10.38 |
-0.3 |
0 |
|
|
20327 |
583139 |
1 |
C13H18 |
A13B18 |
-9.9 |
0.59 |
-9.0 |
0.6 |
0 |
|
|
20328 |
583142 |
1 |
NO3C12H13 |
AB3C12D13 |
-96.73 |
6.8 |
-9.75 |
-0.91 |
0 |
|
|
20329 |
583144 |
1 |
O2C11H12 |
A2B11C12 |
-63.12 |
5.45 |
-9.68 |
-0.22 |
0 |
|
|
20330 |
583155 |
1 |
C19H30 |
A19B30 |
-36.72 |
0.92 |
-8.97 |
0.59 |
0 |
|
|
20331 |
583156 |
1 |
NO2C11H11 |
AB2C11D11 |
-15.69 |
5.62 |
-9.66 |
-0.93 |
0 |
|
|
20332 |
583157 |
1 |
NOC12H15 |
ABC12D15 |
-33.37 |
1.91 |
-8.41 |
0.37 |
0 |
|
|
20333 |
583175 |
1 |
Si2O8C41H72 |
A2B8C41D72 |
-561.26 |
3.6 |
-9.36 |
0.37 |
0 |
|
|
20334 |
583185 |
1 |
SN5H9C10 |
AB5C9D10 |
100.29 |
1.71 |
-8.99 |
-0.84 |
0 |
|
|
20335 |
583187 |
1 |
SSi2C16H28 |
AB2C16D28 |
-44.27 |
2.35 |
-7.8 |
0.14 |
0 |
|
|
20336 |
583200 |
1 |
ClN2H13C16 |
AB2C13D16 |
92.94 |
1.08 |
-8.67 |
-0.37 |
0 |
|
|
20337 |
583203 |
1 |
O3C26H42 |
A3B26C42 |
-196.2 |
3.6 |
-9.46 |
0.91 |
0 |
|
|
20338 |
583205 |
1 |
NO3C16H19 |
AB3C16D19 |
-116.49 |
4.84 |
-9.22 |
0.06 |
0 |
|
|
20339 |
583208 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-5.17 |
4.39 |
-9.13 |
-0.55 |
0 |