List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
199295 |
79226989 |
1 |
ON2C16H24 |
AB2C16D24 |
-26.27 |
2.74 |
-8.72 |
0.22 |
0 |
|
|
199296 |
79227000 |
1 |
ON4C11H12 |
AB4C11D12 |
41.53 |
2.88 |
-8.97 |
-0.13 |
0 |
|
|
199297 |
79227001 |
1 |
BrON3C12H12 |
ABC3D12E12 |
32.65 |
2.5 |
-8.7 |
-0.1 |
0 |
|
|
199298 |
79227093 |
1 |
SN3C14H17 |
AB3C14D17 |
66.54 |
3.28 |
-8.45 |
-0.07 |
0 |
|
|
199299 |
79227094 |
1 |
OSC17H20 |
ABC17D20 |
-33.43 |
4.57 |
-8.5 |
-0.12 |
0 |
|
|
199300 |
79227095 |
1 |
OSC14H14 |
ABC14D14 |
-10.34 |
5.19 |
-8.61 |
-0.22 |
0 |
|
|
199301 |
79227835 |
1 |
SN2C17H18 |
AB2C17D18 |
41.93 |
2.91 |
-7.86 |
0.14 |
0 |
|
|
199302 |
79227953 |
1 |
NSC19H31 |
ABC19D31 |
-23.19 |
2.83 |
-8.3 |
0.16 |
0 |
|
|
199303 |
79228008 |
1 |
SO2C18H20 |
AB2C18D20 |
-54.45 |
2.79 |
-8.65 |
-0.05 |
0 |
|
|
199304 |
79228056 |
1 |
SO2C18H20 |
AB2C18D20 |
-50.16 |
5.87 |
-8.55 |
-0.34 |
0 |
|
|
199305 |
79228316 |
1 |
ClN2O2S2C14H17 |
AB2C2D2E14F17 |
-45.65 |
10.25 |
-9.2 |
-0.76 |
0 |
|
|
199306 |
79228317 |
1 |
NSO2C14H19 |
ABC2D14E19 |
-75.71 |
4.02 |
-8.85 |
-0.3 |
0 |
|
|
199307 |
79228318 |
1 |
SN2C16H22 |
AB2C16D22 |
104.13 |
2.49 |
-8.35 |
0.18 |
0 |
|
|
199308 |
79228683 |
1 |
NOSC17H25 |
ABCD17E25 |
-13.75 |
1.59 |
-8.56 |
-0.09 |
0 |
|
|
199309 |
79228711 |
1 |
NSO2C14H17 |
ABC2D14E17 |
-45.57 |
4.81 |
-8.47 |
0.06 |
0 |
|
|
199310 |
79228712 |
1 |
NSO2C13H17 |
ABC2D13E17 |
-43.96 |
6.04 |
-9.0 |
-0.48 |
0 |
|
|
199311 |
79228713 |
1 |
NSO2C14H21 |
ABC2D14E21 |
-84.96 |
6.17 |
-9.08 |
-0.48 |
0 |
|
|
199312 |
79228872 |
1 |
NSC15H25 |
ABC15D25 |
-6.58 |
2.67 |
-8.6 |
-0.13 |
0 |
|
|
199313 |
79229177 |
1 |
OSC15H22 |
ABC15D22 |
-51.05 |
2.54 |
-8.4 |
0.08 |
0 |
|
|
199314 |
79229379 |
1 |
OSN2C16H24 |
ABC2D16E24 |
-23.09 |
3.73 |
-8.7 |
-0.25 |
0 |
|
|
199315 |
79229380 |
1 |
NO2C16H21 |
AB2C16D21 |
-65.12 |
4.1 |
-8.82 |
0.09 |
0 |
|
|
199316 |
79229940 |
1 |
SO5C11H12 |
AB5C11D12 |
-187.69 |
2.27 |
-9.13 |
-0.31 |
0 |
|
|
199317 |
79229941 |
1 |
SO5C12H14 |
AB5C12D14 |
-190.51 |
3.96 |
-9.09 |
-0.33 |
0 |
|
|
199318 |
79229942 |
1 |
BrNO2H12C14 |
ABC2D12E14 |
-13.12 |
1.97 |
-9.06 |
-0.74 |
0 |
|
|
199319 |
79229943 |
1 |
NO3C12H15 |
AB3C12D15 |
-104.63 |
0.69 |
-8.95 |
-0.01 |
0 |
|
|
199320 |
79229944 |
1 |
NO3C13H17 |
AB3C13D17 |
-112.81 |
1.02 |
-8.94 |
0.0 |
0 |
|
|
199321 |
79229945 |
1 |
O2N3C12H17 |
A2B3C12D17 |
-14.44 |
2.23 |
-8.82 |
0.07 |
0 |
|
|
199322 |
79229960 |
1 |
O2C15H18 |
A2B15C18 |
-75.08 |
4.32 |
-8.64 |
0.33 |
0 |
|
|
199323 |
79229961 |
1 |
NOC16H25 |
ABC16D25 |
-45.8 |
1.26 |
-8.76 |
0.19 |
0 |
|
|
199324 |
79230013 |
1 |
NOC16H23 |
ABC16D23 |
-36.41 |
2.71 |
-8.67 |
0.27 |
0 |
|
|
199325 |
79230014 |
1 |
NSO5C13H25 |
ABC5D13E25 |
-249.1 |
1.37 |
-9.66 |
0.4 |
0 |
|
|
199326 |
79231292 |
1 |
SN3C14H17 |
AB3C14D17 |
53.68 |
2.25 |
-8.37 |
-0.3 |
0 |
|
|
199327 |
79231293 |
1 |
SO2N3C11H17 |
AB2C3D11E17 |
-59.08 |
7.51 |
-8.6 |
-0.04 |
0 |
|
|
199328 |
79231294 |
1 |
ON3C13H15 |
AB3C13D15 |
-2.04 |
5.36 |
-8.74 |
-0.17 |
0 |
|
|
199329 |
79231295 |
1 |
ON3C12H13 |
AB3C12D13 |
-2.98 |
5.32 |
-8.9 |
-0.22 |
0 |
|
|
199330 |
79231296 |
1 |
ON3C17H23 |
AB3C17D23 |
-1.84 |
6.61 |
-8.74 |
0.06 |
0 |
|
|
199331 |
79231297 |
1 |
BrNOC18H20 |
ABCD18E20 |
-3.41 |
2.0 |
-8.65 |
-0.11 |
0 |
|
|
199332 |
79231298 |
1 |
BrNOC18H20 |
ABCD18E20 |
-4.07 |
1.25 |
-8.51 |
-0.04 |
0 |
|
|
199333 |
79231299 |
1 |
S2N5C9H11 |
A2B5C9D11 |
97.51 |
4.04 |
-9.02 |
-0.98 |
0 |
|
|
199334 |
79231300 |
1 |
ClN4C12H15 |
AB4C12D15 |
55.57 |
4.57 |
-8.86 |
-0.34 |
0 |
|
|
199335 |
79231301 |
1 |
ON2C18H28 |
AB2C18D28 |
-38.09 |
1.25 |
-8.43 |
0.38 |
0 |
|
|
199336 |
79231302 |
1 |
ON2C18H26 |
AB2C18D26 |
-11.57 |
2.02 |
-8.53 |
0.22 |
0 |
|
|
199337 |
79231380 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-0.29 |
5.32 |
-8.32 |
-0.34 |
0 |
|
|
199338 |
79231381 |
1 |
ON4C16H20 |
AB4C16D20 |
31.75 |
4.27 |
-8.2 |
-0.19 |
0 |
|
|
199339 |
79231382 |
1 |
ON4C16H18 |
AB4C16D18 |
64.86 |
3.83 |
-8.24 |
-0.28 |
0 |
|
|
199340 |
79231383 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-2.79 |
2.44 |
-8.27 |
-0.31 |
0 |
|
|
199341 |
79231384 |
1 |
ON4C16H20 |
AB4C16D20 |
32.57 |
4.06 |
-8.24 |
-0.23 |
0 |
|
|
199342 |
79232485 |
1 |
SN4O4C12H18 |
AB4C4D12E18 |
-83.56 |
5.68 |
-9.87 |
-0.29 |
0 |
|
|
199343 |
79232486 |
1 |
SN2O4C14H18 |
AB2C4D14E18 |
-106.02 |
4.9 |
-9.73 |
-0.25 |
0 |
|
|
199344 |
79232487 |
1 |
SN2O4C14H18 |
AB2C4D14E18 |
-101.91 |
3.89 |
-9.63 |
-0.28 |
0 |