List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
365192 |
127317009 |
1 |
N7C19H27 |
A7B19C27 |
88.15 |
4.11 |
-8.63 |
-0.38 |
0 |
|
|
365193 |
127317010 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-38.04 |
3.86 |
-8.71 |
0.16 |
0 |
|
|
365194 |
127317011 |
2 |
ON3C10H13 |
AB3C10D13 |
-23.99 |
4.64 |
-8.68 |
-0.3 |
0 |
|
|
365195 |
127317012 |
1 |
SO3N5C17H29 |
AB3C5D17E29 |
-105.56 |
7.14 |
-8.85 |
0.57 |
0 |
|
|
365196 |
127317013 |
1 |
O2N6C19H24 |
A2B6C19D24 |
-19.49 |
3.54 |
-8.79 |
-0.36 |
0 |
|
|
365197 |
127317014 |
1 |
O2N4C17H30 |
A2B4C17D30 |
-79.38 |
4.81 |
-8.78 |
0.44 |
0 |
|
|
365198 |
127317015 |
1 |
O2N5C20H35 |
A2B5C20D35 |
-76.93 |
5.59 |
-8.49 |
0.16 |
0 |
|
|
365199 |
127317016 |
1 |
ON5C20H27 |
AB5C20D27 |
40.66 |
6.09 |
-8.93 |
0.03 |
0 |
|
|
365200 |
127317017 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-91.81 |
4.24 |
-9.22 |
-0.18 |
0 |
|
|
365201 |
127317018 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-117.27 |
5.24 |
-8.94 |
-0.01 |
0 |
|
|
365202 |
127317019 |
1 |
O2N4C19H24 |
A2B4C19D24 |
20.56 |
5.31 |
-9.07 |
-0.57 |
0 |
|
|
365203 |
127317020 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-46.43 |
7.76 |
-8.88 |
-0.1 |
0 |
|
|
365204 |
127317021 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-56.15 |
5.07 |
-8.83 |
-0.01 |
0 |
|
|
365205 |
127317022 |
1 |
O2N3C24H35 |
A2B3C24D35 |
-80.59 |
2.25 |
-8.9 |
-0.09 |
0 |
|
|
365206 |
127317023 |
1 |
SO2N5C20H23 |
AB2C5D20E23 |
1.67 |
7.29 |
-9.17 |
-0.92 |
0 |
|
|
365207 |
127317024 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-87.31 |
7.35 |
-8.8 |
0.05 |
0 |
|
|
365208 |
127317025 |
1 |
ON5C22H29 |
AB5C22D29 |
12.57 |
3.86 |
-8.81 |
-0.46 |
0 |
|
|
365209 |
127317026 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-101.92 |
4.16 |
-8.62 |
0.7 |
0 |
|
|
365210 |
127317027 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-69.77 |
4.03 |
-9.18 |
0.17 |
0 |
|
|
365211 |
127317028 |
1 |
ON5C23H31 |
AB5C23D31 |
12.5 |
2.59 |
-8.79 |
-0.33 |
0 |
|
|
365212 |
127317029 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-63.29 |
2.47 |
-9.06 |
0.33 |
0 |
|
|
365213 |
127317056 |
2 |
ON2C11H16 |
AB2C11D16 |
-71.96 |
4.03 |
-8.55 |
-0.27 |
0 |
|
|
365214 |
127317057 |
1 |
OSN4C21H30 |
ABC4D21E30 |
-17.16 |
7.34 |
-8.72 |
-0.46 |
0 |
|
|
365215 |
127317063 |
2 |
ON2C9H16 |
AB2C9D16 |
-111.21 |
1.66 |
-8.57 |
0.88 |
0 |
|
|
365216 |
127317064 |
1 |
ON5C20H27 |
AB5C20D27 |
22.89 |
3.92 |
-8.58 |
-0.54 |
0 |
|
|
365217 |
127317065 |
1 |
ClO2N4C19H27 |
AB2C4D19E27 |
-87.89 |
6.69 |
-8.79 |
-0.08 |
0 |
|
|
365218 |
127317066 |
2 |
FON2C9H12 |
ABC2D9E12 |
-156.65 |
4.76 |
-8.69 |
-0.5 |
0 |
|
|
365219 |
127317067 |
1 |
OSN4C20H28 |
ABC4D20E28 |
-11.48 |
7.03 |
-8.71 |
-0.46 |
0 |
|
|
365220 |
127317068 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-82.42 |
3.86 |
-8.4 |
-0.06 |
0 |
|
|
365221 |
127317069 |
1 |
OSN5C20H27 |
ABC5D20E27 |
20.65 |
4.25 |
-8.62 |
-1.22 |
0 |
|
|
365222 |
127317070 |
1 |
N6C17H24 |
A6B17C24 |
98.1 |
5.24 |
-8.57 |
-0.99 |
0 |
|
|
365223 |
127317071 |
1 |
ON5C20H31 |
AB5C20D31 |
-25.29 |
3.79 |
-7.99 |
0.09 |
0 |
|
|
365224 |
127317072 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-108.92 |
1.55 |
-8.41 |
0.38 |
0 |
|
|
365225 |
127317073 |
1 |
O2N5C21H25 |
A2B5C21D25 |
50.04 |
4.9 |
-8.68 |
-0.76 |
0 |
|
|
365226 |
127317074 |
1 |
SN3O4C19H33 |
AB3C4D19E33 |
-184.6 |
10.36 |
-8.71 |
0.66 |
0 |
|
|
365227 |
127317075 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-100.33 |
2.04 |
-8.3 |
0.08 |
0 |
|
|
365228 |
127317076 |
1 |
SN3O3C18H33 |
AB3C3D18E33 |
-149.5 |
5.91 |
-8.52 |
0.71 |
0 |
|
|
365229 |
127317077 |
1 |
SO2N4C16H22 |
AB2C4D16E22 |
-39.59 |
7.7 |
-8.83 |
-0.58 |
0 |
|
|
365230 |
127317078 |
2 |
ON2C9H12 |
AB2C9D12 |
9.2 |
6.35 |
-8.36 |
-0.84 |
0 |
|
|
365231 |
127317079 |
1 |
FOSN5C18H22 |
ABCD5E18F22 |
-13.03 |
7.22 |
-8.94 |
-1.3 |
0 |
|
|
365232 |
127317080 |
1 |
ON5C22H29 |
AB5C22D29 |
42.73 |
5.67 |
-8.73 |
-0.33 |
0 |
|
|
365233 |
127317081 |
1 |
FON5C20H26 |
ABC5D20E26 |
-26.66 |
4.98 |
-8.78 |
-0.53 |
0 |
|
|
365234 |
127317082 |
1 |
ClON5C20H26 |
ABC5D20E26 |
14.79 |
5.43 |
-8.73 |
-0.45 |
0 |
|
|
365235 |
127317083 |
1 |
SN3O3C20H35 |
AB3C3D20E35 |
-154.53 |
8.38 |
-8.69 |
0.75 |
0 |
|
|
365236 |
127317084 |
2 |
ON2C9H16 |
AB2C9D16 |
-124.46 |
4.14 |
-8.74 |
0.39 |
0 |
|
|
365237 |
127317085 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-5.07 |
7.6 |
-8.82 |
-0.91 |
0 |
|
|
365238 |
127317086 |
2 |
ON2C7H12 |
AB2C7D12 |
-79.18 |
4.69 |
-8.78 |
0.2 |
0 |
|
|
365239 |
127317087 |
1 |
OSN4C21H30 |
ABC4D21E30 |
-14.53 |
7.0 |
-8.7 |
-0.43 |
0 |
|
|
365240 |
127317585 |
1 |
ON6C21H30 |
AB6C21D30 |
16.56 |
6.09 |
-8.51 |
-0.15 |
0 |
|
|
365241 |
127317586 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-34.14 |
4.35 |
-8.99 |
-0.03 |
0 |
|
|
365242 |
127317587 |
1 |
N2S2O3C13H24 |
A2B2C3D13E24 |
-147.37 |
7.12 |
-8.57 |
0.6 |
0 |
|
|
365243 |
127317588 |
1 |
SN2O4C16H20 |
AB2C4D16E20 |
-141.05 |
4.76 |
-8.5 |
-0.8 |
0 |
|
|
365244 |
127317589 |
1 |
SO2N3C16H19 |
AB2C3D16E19 |
-63.46 |
6.87 |
-8.4 |
-1.07 |
0 |
|
|
365245 |
127317590 |
1 |
OSN5C18H23 |
ABC5D18E23 |
19.05 |
5.81 |
-8.47 |
-0.13 |
0 |
|
|
365246 |
127317591 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
-30.24 |
4.5 |
-8.86 |
-0.7 |
0 |
|
|
365247 |
127317592 |
1 |
SN2O3C21H26 |
AB2C3D21E26 |
-99.41 |
5.64 |
-8.27 |
-0.54 |
0 |
|
|
365248 |
127317593 |
1 |
S2N3O3C17H27 |
A2B3C3D17E27 |
-117.61 |
5.47 |
-9.3 |
-0.68 |
0 |
|
|
365249 |
127317594 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-0.34 |
6.52 |
-8.92 |
-0.75 |
0 |
|
|
365250 |
127317595 |
1 |
OS2N4C17H20 |
AB2C4D17E20 |
27.69 |
2.66 |
-8.86 |
-0.6 |
0 |
|
|
365251 |
127317596 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
-35.6 |
3.65 |
-8.54 |
-0.58 |
0 |
|
|
365252 |
127317597 |
1 |
SN2O2C22H32 |
AB2C2D22E32 |
-115.98 |
3.29 |
-9.15 |
-0.33 |
0 |
|
|
365253 |
127317598 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-105.57 |
4.04 |
-8.58 |
-0.64 |
0 |
|
|
365254 |
127317599 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-70.82 |
2.46 |
-8.7 |
-0.44 |
0 |
|
|
365255 |
127317600 |
1 |
F2O2N3C17H21 |
A2B2C3D17E21 |
-149.08 |
1.59 |
-8.68 |
-1.09 |
0 |
|
|
365256 |
127317601 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-108.16 |
5.97 |
-8.51 |
-0.19 |
0 |
|
|
365257 |
127317602 |
1 |
OSN5C21H27 |
ABC5D21E27 |
21.03 |
2.5 |
-8.59 |
-0.53 |
0 |
|
|
365258 |
127317603 |
1 |
FON4C18H21 |
ABC4D18E21 |
-16.51 |
3.12 |
-8.68 |
-0.68 |
0 |
|
|
365259 |
127317604 |
1 |
ON5C21H35 |
AB5C21D35 |
-34.32 |
6.07 |
-8.36 |
0.01 |
0 |
|
|
365260 |
127317605 |
1 |
SO2N3C15H21 |
AB2C3D15E21 |
-48.48 |
1.22 |
-8.61 |
-0.81 |
0 |
|
|
365261 |
127317606 |
1 |
O3N4C14H22 |
A3B4C14D22 |
-128.73 |
3.4 |
-8.81 |
-0.14 |
0 |
|
|
365262 |
127317607 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-17.54 |
5.94 |
-8.76 |
-0.82 |
0 |
|
|
365263 |
127317608 |
1 |
ON3C14H25 |
AB3C14D25 |
-40.27 |
3.99 |
-8.54 |
1.09 |
0 |
|
|
365264 |
127317609 |
1 |
SN3O3C15H27 |
AB3C3D15E27 |
-125.47 |
5.64 |
-8.91 |
0.58 |
0 |
|
|
365265 |
127317610 |
1 |
N3O4C18H23 |
A3B4C18D23 |
-118.48 |
3.77 |
-8.69 |
-0.86 |
0 |
|
|
365266 |
127317611 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-65.42 |
2.6 |
-8.7 |
-0.27 |
0 |
|
|
365267 |
127317612 |
1 |
O2F3N4C19H21 |
A2B3C4D19E21 |
-155.75 |
4.55 |
-8.51 |
-1.28 |
0 |
|
|
365268 |
127317613 |
1 |
ON5C20H33 |
AB5C20D33 |
-32.59 |
6.6 |
-8.37 |
0.01 |
0 |
|
|
365269 |
127317614 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-67.9 |
2.32 |
-8.56 |
-0.32 |
0 |
|
|
365270 |
127317615 |
2 |
ON2C9H11 |
AB2C9D11 |
-10.39 |
7.24 |
-8.44 |
-0.97 |
0 |
|
|
365271 |
127317616 |
1 |
ON4C12H18 |
AB4C12D18 |
-0.89 |
2.26 |
-8.81 |
-0.35 |
0 |
|
|
365272 |
127317617 |
1 |
F2O2N3C17H21 |
A2B2C3D17E21 |
-149.58 |
2.11 |
-8.62 |
-0.95 |
0 |
|
|
365273 |
127317618 |
1 |
ClFO2N3C17H21 |
ABC2D3E17F21 |
-110.07 |
2.31 |
-8.59 |
-1.01 |
0 |
|
|
365274 |
127317619 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-78.11 |
1.1 |
-8.83 |
-0.13 |
0 |
|
|
365275 |
127317620 |
1 |
O2N3C17H29 |
A2B3C17D29 |
-106.49 |
1.4 |
-8.62 |
0.61 |
0 |
|
|
365276 |
127317621 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-114.72 |
2.59 |
-8.78 |
-0.43 |
0 |
|
|
365277 |
127317632 |
1 |
O2N3C22H27 |
A2B3C22D27 |
-56.61 |
4.72 |
-8.57 |
-0.89 |
0 |
|
|
365278 |
127317633 |
1 |
SN3O3C15H27 |
AB3C3D15E27 |
-134.22 |
3.39 |
-8.8 |
0.64 |
0 |
|
|
365279 |
127317634 |
1 |
O2N3C22H27 |
A2B3C22D27 |
-56.74 |
2.54 |
-8.78 |
-0.41 |
0 |
|
|
365280 |
127317635 |
1 |
O2N4C11H20 |
A2B4C11D20 |
-96.41 |
2.57 |
-8.6 |
0.59 |
0 |
|
|
365281 |
127317636 |
1 |
ON4C13H20 |
AB4C13D20 |
-22.61 |
3.69 |
-8.8 |
-0.04 |
0 |
|
|
365282 |
127317637 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-78.59 |
3.93 |
-8.56 |
-0.32 |
0 |
|
|
365283 |
127317638 |
2 |
ON2C9H11 |
AB2C9D11 |
-20.39 |
6.18 |
-8.59 |
-0.88 |
0 |
|
|
365284 |
127317639 |
1 |
ON4C12H18 |
AB4C12D18 |
-11.64 |
3.97 |
-8.86 |
-0.2 |
0 |
|
|
365285 |
127317647 |
1 |
ON4C12H20 |
AB4C12D20 |
-10.17 |
5.36 |
-8.6 |
0.2 |
0 |
|
|
365286 |
127317648 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-38.95 |
2.39 |
-8.76 |
-0.6 |
0 |
|
|
365287 |
127317649 |
1 |
N3O3C17H31 |
A3B3C17D31 |
-161.68 |
3.89 |
-8.88 |
0.78 |
0 |
|
|
365288 |
127317650 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-161.74 |
6.79 |
-8.32 |
0.11 |
0 |
|
|
365289 |
127317651 |
1 |
ON5C14H23 |
AB5C14D23 |
-6.33 |
5.85 |
-9.22 |
0.13 |
0 |
|
|
365290 |
127317652 |
1 |
ON5C15H25 |
AB5C15D25 |
-13.67 |
2.97 |
-8.71 |
0.06 |
0 |
|
|
365291 |
127317653 |
1 |
ON4C13H20 |
AB4C13D20 |
-1.97 |
4.39 |
-9.65 |
0.1 |
0 |