List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
367192 |
127323960 |
1 |
ON5C20H27 |
AB5C20D27 |
8.04 |
3.66 |
-9.48 |
0.07 |
0 |
|
|
367193 |
127323961 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-70.87 |
3.88 |
-8.83 |
0.15 |
0 |
|
|
367194 |
127323962 |
1 |
ON6C17H28 |
AB6C17D28 |
-6.21 |
5.66 |
-9.23 |
0.59 |
0 |
|
|
367195 |
127323963 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-63.88 |
3.37 |
-8.98 |
-0.34 |
0 |
|
|
367196 |
127323964 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-112.25 |
5.25 |
-9.02 |
-0.41 |
0 |
|
|
367197 |
127323967 |
1 |
O2N5C21H31 |
A2B5C21D31 |
-58.8 |
4.93 |
-8.81 |
0.08 |
0 |
|
|
367198 |
127323968 |
1 |
ON5C14H23 |
AB5C14D23 |
5.54 |
3.64 |
-9.03 |
0.69 |
0 |
|
|
367199 |
127323969 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-55.55 |
2.35 |
-8.86 |
0.26 |
0 |
|
|
367200 |
127323970 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-92.46 |
2.01 |
-8.85 |
-0.2 |
0 |
|
|
367201 |
127323971 |
1 |
ON5C17H23 |
AB5C17D23 |
19.0 |
5.29 |
-8.83 |
-0.72 |
0 |
|
|
367202 |
127323972 |
1 |
O2N6C15H24 |
A2B6C15D24 |
-64.56 |
5.43 |
-9.48 |
0.57 |
0 |
|
|
367203 |
127323973 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-110.6 |
6.42 |
-9.51 |
0.15 |
0 |
|
|
367204 |
127323974 |
2 |
ON2C7H12 |
AB2C7D12 |
-72.78 |
8.08 |
-9.22 |
0.48 |
0 |
|
|
367205 |
127323977 |
1 |
OF3N5C16H24 |
AB3C5D16E24 |
-201.72 |
1.22 |
-9.63 |
0.42 |
0 |
|
|
367206 |
127323978 |
1 |
O2F3N4C18H27 |
A2B3C4D18E27 |
-245.94 |
4.76 |
-9.2 |
0.12 |
0 |
|
|
367207 |
127323979 |
1 |
ON5C19H29 |
AB5C19D29 |
-10.28 |
3.03 |
-8.59 |
-0.03 |
0 |
|
|
367208 |
127323980 |
1 |
OSN6C15H22 |
ABC6D15E22 |
4.87 |
3.53 |
-9.31 |
-0.44 |
0 |
|
|
367209 |
127323981 |
1 |
OSN4C14H22 |
ABC4D14E22 |
-10.64 |
3.65 |
-8.96 |
-0.52 |
0 |
|
|
367210 |
127323982 |
1 |
ON5C18H27 |
AB5C18D27 |
-4.23 |
2.7 |
-8.47 |
0.08 |
0 |
|
|
367211 |
127323983 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-42.13 |
2.56 |
-9.05 |
-0.22 |
0 |
|
|
367212 |
127323984 |
1 |
SO3N4C15H28 |
AB3C4D15E28 |
-130.56 |
5.63 |
-9.05 |
0.39 |
0 |
|
|
367213 |
127323985 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-96.02 |
4.2 |
-9.42 |
0.92 |
0 |
|
|
367214 |
127323986 |
1 |
O2N5C15H23 |
A2B5C15D23 |
-38.89 |
5.09 |
-9.49 |
0.56 |
0 |
|
|
367215 |
127323987 |
2 |
ON3C9H14 |
AB3C9D14 |
-53.07 |
2.31 |
-9.62 |
0.4 |
0 |
|
|
367216 |
127323988 |
1 |
O3N5C20H31 |
A3B5C20D31 |
-97.23 |
5.5 |
-9.21 |
0.12 |
0 |
|
|
367217 |
127323989 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-67.31 |
3.61 |
-9.03 |
0.82 |
0 |
|
|
367218 |
127323993 |
1 |
ON5C17H33 |
AB5C17D33 |
-40.33 |
3.25 |
-8.73 |
1.06 |
0 |
|
|
367219 |
127323994 |
2 |
ON2C11H17 |
AB2C11D17 |
-92.01 |
3.48 |
-8.65 |
0.08 |
0 |
|
|
367220 |
127323995 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-83.08 |
7.23 |
-9.13 |
-0.73 |
0 |
|
|
367221 |
127323996 |
1 |
ON5C20H31 |
AB5C20D31 |
-13.25 |
4.86 |
-8.43 |
-0.02 |
0 |
|
|
367222 |
127323997 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-38.56 |
3.2 |
-8.73 |
-0.17 |
0 |
|
|
367223 |
127323998 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-54.26 |
2.34 |
-8.68 |
-0.3 |
0 |
|
|
367224 |
127323999 |
1 |
O2N7C20H29 |
A2B7C20D29 |
-31.28 |
0.93 |
-8.7 |
-0.3 |
0 |
|
|
367225 |
127324000 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-47.02 |
2.61 |
-8.74 |
-0.32 |
0 |
|
|
367226 |
127324001 |
1 |
ON5C19H29 |
AB5C19D29 |
-7.73 |
4.75 |
-8.47 |
-0.04 |
0 |
|
|
367227 |
127324002 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-57.07 |
2.74 |
-9.03 |
-0.11 |
0 |
|
|
367228 |
127324003 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-50.03 |
4.18 |
-8.95 |
-0.3 |
0 |
|
|
367229 |
127324004 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-56.93 |
2.0 |
-8.98 |
-0.22 |
0 |
|
|
367230 |
127324005 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-41.02 |
4.08 |
-9.1 |
-0.24 |
0 |
|
|
367231 |
127324006 |
2 |
ON2C8H12 |
AB2C8D12 |
-49.55 |
2.55 |
-8.98 |
-0.18 |
0 |
|
|
367232 |
127324007 |
1 |
ON5C21H29 |
AB5C21D29 |
-10.94 |
2.3 |
-9.41 |
0.3 |
0 |
|
|
367233 |
127324010 |
1 |
ON6C20H32 |
AB6C20D32 |
-2.07 |
4.48 |
-8.43 |
-0.21 |
0 |
|
|
367234 |
127324011 |
1 |
ON5C17H27 |
AB5C17D27 |
3.43 |
4.87 |
-8.41 |
-0.17 |
0 |
|
|
367235 |
127324012 |
1 |
ON6C20H36 |
AB6C20D36 |
-48.3 |
4.31 |
-8.65 |
0.56 |
0 |
|
|
367236 |
127324013 |
2 |
ON3C8H14 |
AB3C8D14 |
-64.28 |
2.6 |
-8.76 |
0.41 |
0 |
|
|
367237 |
127324014 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-110.74 |
2.61 |
-8.86 |
-0.36 |
0 |
|
|
367238 |
127324015 |
1 |
O2N4C15H28 |
A2B4C15D28 |
-78.83 |
1.64 |
-8.92 |
1.21 |
0 |
|
|
367239 |
127324016 |
1 |
ON5C16H25 |
AB5C16D25 |
2.74 |
3.75 |
-9.06 |
-0.18 |
0 |
|
|
367240 |
127324017 |
1 |
ON6C18H32 |
AB6C18D32 |
-40.42 |
1.63 |
-8.55 |
0.47 |
0 |
|
|
367241 |
127324018 |
1 |
ON6C17H30 |
AB6C17D30 |
-37.82 |
4.45 |
-9.01 |
0.57 |
0 |
|
|
367242 |
127324019 |
1 |
ON5C14H23 |
AB5C14D23 |
4.29 |
3.64 |
-9.09 |
0.66 |
0 |
|
|
367243 |
127324020 |
2 |
ON2C10H15 |
AB2C10D15 |
-80.05 |
4.57 |
-8.79 |
0.52 |
0 |
|
|
367244 |
127324021 |
1 |
O2N4C15H26 |
A2B4C15D26 |
-86.15 |
5.0 |
-8.8 |
0.36 |
0 |
|
|
367245 |
127324022 |
1 |
ClSO2N3C18H20 |
ABC2D3E18F20 |
-45.78 |
2.31 |
-9.36 |
-0.58 |
0 |
|
|
367246 |
127324023 |
1 |
OSN5C17H25 |
ABC5D17E25 |
-17.85 |
2.29 |
-9.04 |
0.01 |
0 |
|
|
367247 |
127324024 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-60.33 |
6.24 |
-9.06 |
-0.03 |
0 |
|
|
367248 |
127324025 |
2 |
ON2C10H14 |
AB2C10D14 |
-42.56 |
3.72 |
-8.86 |
-0.13 |
0 |
|
|
367249 |
127324026 |
2 |
ON2C10H15 |
AB2C10D15 |
-47.55 |
3.1 |
-8.82 |
0.02 |
0 |
|
|
367250 |
127324027 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-57.96 |
2.41 |
-8.99 |
-0.07 |
0 |
|
|
367251 |
127324028 |
1 |
O2N5C18H31 |
A2B5C18D31 |
-85.8 |
3.59 |
-9.53 |
0.53 |
0 |
|
|
367252 |
127324029 |
1 |
ON5C21H33 |
AB5C21D33 |
-6.48 |
4.55 |
-7.95 |
0.66 |
0 |
|
|
367253 |
127324030 |
1 |
ON4C15H22 |
AB4C15D22 |
-8.29 |
2.37 |
-9.02 |
-0.19 |
0 |
|
|
367254 |
127324031 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-56.16 |
2.92 |
-8.71 |
0.06 |
0 |
|
|
367255 |
127324032 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-94.27 |
6.98 |
-9.46 |
0.1 |
0 |
|
|
367256 |
127324033 |
1 |
OCl2N5C15H21 |
AB2C5D15E21 |
-10.83 |
4.61 |
-8.79 |
-0.6 |
0 |
|
|
367257 |
127324034 |
1 |
ON5C19H31 |
AB5C19D31 |
-39.96 |
2.53 |
-9.51 |
0.51 |
0 |
|
|
367258 |
127324035 |
1 |
OSN5C18H23 |
ABC5D18E23 |
3.27 |
1.91 |
-8.61 |
-0.25 |
0 |
|
|
367259 |
127324036 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-45.2 |
1.88 |
-8.56 |
-0.27 |
0 |
|
|
367260 |
127324037 |
1 |
ON5C17H23 |
AB5C17D23 |
10.09 |
2.18 |
-8.94 |
-0.28 |
0 |
|
|
367261 |
127324038 |
1 |
FOSN5C18H22 |
ABCD5E18F22 |
-43.61 |
1.39 |
-8.66 |
-0.57 |
0 |
|
|
367262 |
127324039 |
1 |
FSO2N3C21H22 |
ABC2D3E21F22 |
-91.88 |
2.31 |
-8.62 |
-0.52 |
0 |
|
|
367263 |
127324040 |
1 |
ON5C20H27 |
AB5C20D27 |
-5.0 |
5.03 |
-9.29 |
0.26 |
0 |
|
|
367264 |
127324041 |
1 |
O2N3C23H27 |
A2B3C23D27 |
-57.39 |
3.46 |
-9.24 |
-0.15 |
0 |
|
|
367265 |
127324042 |
1 |
ON5C13H21 |
AB5C13D21 |
8.36 |
4.04 |
-9.31 |
0.4 |
0 |
|
|
367266 |
127324043 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-51.01 |
3.11 |
-8.92 |
0.39 |
0 |
|
|
367267 |
127324044 |
1 |
ON5C18H27 |
AB5C18D27 |
-5.91 |
2.56 |
-8.65 |
0.08 |
0 |
|
|
367268 |
127324045 |
1 |
OF3N6C16H25 |
AB3C6D16E25 |
-185.29 |
4.32 |
-9.59 |
0.42 |
0 |
|
|
367269 |
127324046 |
1 |
ON5C14H23 |
AB5C14D23 |
9.31 |
2.76 |
-9.04 |
0.62 |
0 |
|
|
367270 |
127324047 |
1 |
ON6C17H28 |
AB6C17D28 |
-3.88 |
3.36 |
-9.02 |
0.49 |
0 |
|
|
367271 |
127324048 |
2 |
ON2C8H14 |
AB2C8D14 |
-89.24 |
7.9 |
-8.63 |
0.69 |
0 |
|
|
367272 |
127324049 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-88.61 |
4.09 |
-8.85 |
-0.2 |
0 |
|
|
367273 |
127324050 |
1 |
ON6C20H28 |
AB6C20D28 |
5.34 |
2.81 |
-8.21 |
0.45 |
0 |
|
|
367274 |
127324051 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-74.02 |
3.34 |
-8.81 |
0.64 |
0 |
|
|
367275 |
127324052 |
1 |
ON7C18H27 |
AB7C18D27 |
-4.18 |
6.82 |
-9.09 |
0.63 |
0 |
|
|
367276 |
127324053 |
1 |
ON5C17H27 |
AB5C17D27 |
-17.79 |
4.57 |
-8.73 |
1.0 |
0 |
|
|
367277 |
127324054 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-122.29 |
2.83 |
-8.96 |
0.32 |
0 |
|
|
367278 |
127324055 |
1 |
FON5C20H26 |
ABC5D20E26 |
-22.95 |
1.26 |
-8.98 |
-0.65 |
0 |
|
|
367279 |
127324056 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-77.3 |
2.35 |
-8.97 |
0.31 |
0 |
|
|
367280 |
127324057 |
2 |
ON3C10H13 |
AB3C10D13 |
-53.6 |
4.55 |
-8.95 |
-0.35 |
0 |
|
|
367281 |
127324058 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-68.07 |
3.67 |
-8.88 |
-0.27 |
0 |
|
|
367282 |
127324059 |
1 |
ON7C17H25 |
AB7C17D25 |
12.47 |
5.05 |
-9.42 |
0.52 |
0 |
|
|
367283 |
127324060 |
1 |
ON5C16H25 |
AB5C16D25 |
-1.35 |
5.05 |
-8.91 |
0.69 |
0 |
|
|
367284 |
127324061 |
1 |
ON6C21H30 |
AB6C21D30 |
-0.39 |
2.41 |
-8.74 |
0.35 |
0 |
|
|
367285 |
127324062 |
1 |
ON5C15H25 |
AB5C15D25 |
-6.99 |
3.09 |
-8.94 |
0.65 |
0 |
|
|
367286 |
127324063 |
1 |
OSN5C16H27 |
ABC5D16E27 |
-15.77 |
3.42 |
-8.62 |
0.6 |
0 |
|
|
367287 |
127324064 |
1 |
SN3O3C12H23 |
AB3C3D12E23 |
-122.92 |
5.78 |
-9.48 |
0.37 |
0 |
|
|
367288 |
127324065 |
1 |
ON6C20H28 |
AB6C20D28 |
4.52 |
1.0 |
-7.82 |
0.42 |
0 |
|
|
367289 |
127324066 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-57.19 |
4.12 |
-8.96 |
0.0 |
0 |
|
|
367290 |
127324067 |
1 |
ON5C16H27 |
AB5C16D27 |
-45.77 |
2.18 |
-9.51 |
0.51 |
0 |
|
|
367291 |
127324070 |
1 |
ClN3O3C17H22 |
AB3C3D17E22 |
-87.37 |
4.02 |
-8.91 |
-0.32 |
0 |