List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
122162 |
50796526 |
1 |
O2N5H19C21 |
A2B5C19D21 |
62.87 |
2.72 |
-8.71 |
-0.92 |
0 |
|
|
122163 |
50796527 |
1 |
O2N5C29H33 |
A2B5C29D33 |
8.02 |
2.63 |
-8.52 |
-0.8 |
0 |
|
|
122164 |
50796545 |
1 |
FS2N3O5H14C16 |
AB2C3D5E14F16 |
-190.17 |
9.62 |
-8.95 |
-1.37 |
0 |
|
|
122165 |
50796546 |
1 |
ON5C27H31 |
AB5C27D31 |
71.36 |
1.22 |
-8.22 |
-0.59 |
0 |
|
|
122166 |
50796547 |
1 |
ON5C22H29 |
AB5C22D29 |
42.83 |
3.7 |
-8.22 |
-0.57 |
0 |
|
|
122167 |
50796599 |
1 |
SN3O4C15H15 |
AB3C4D15E15 |
-113.32 |
6.55 |
-8.43 |
-0.66 |
0 |
|
|
122168 |
50796600 |
1 |
SN3O3C16H17 |
AB3C3D16E17 |
-90.92 |
6.72 |
-8.39 |
-0.66 |
0 |
|
|
122169 |
50796606 |
1 |
ClN3O3H12C15 |
AB3C3D12E15 |
-71.44 |
9.61 |
-8.82 |
-0.64 |
0 |
|
|
122170 |
50796607 |
1 |
N3O3H15C16 |
A3B3C15D16 |
-69.01 |
8.48 |
-8.71 |
-0.47 |
0 |
|
|
122171 |
50796702 |
1 |
N3O5C18H19 |
A3B5C18D19 |
-149.52 |
10.99 |
-8.45 |
-0.3 |
0 |
|
|
122172 |
50796813 |
1 |
ClSN3O3C18H20 |
ABC3D3E18F20 |
-98.76 |
5.54 |
-8.48 |
-0.63 |
0 |
|
|
122173 |
50796840 |
1 |
BrSN3O3C16H16 |
ABC3D3E16F16 |
-65.85 |
6.12 |
-8.13 |
-1.04 |
0 |
|
|
122174 |
50796991 |
1 |
N2O3H16C17 |
A2B3C16D17 |
-78.98 |
8.32 |
-8.68 |
-0.59 |
0 |
|
|
122175 |
50796992 |
1 |
BrN2O4H15C17 |
AB2C4D15E17 |
-109.5 |
7.92 |
-8.66 |
-1.0 |
0 |
|
|
122176 |
50796997 |
1 |
OF4N5H23C26 |
AB4C5D23E26 |
-131.14 |
3.77 |
-8.79 |
-1.04 |
0 |
|
|
122177 |
50796998 |
1 |
O3N5C29H33 |
A3B5C29D33 |
-26.38 |
6.33 |
-8.16 |
-0.43 |
0 |
|
|
122178 |
50796999 |
1 |
ClON5C28H30 |
ABC5D28E30 |
40.81 |
4.67 |
-8.22 |
-0.45 |
0 |
|
|
122179 |
50797000 |
1 |
ClO2N5C26H26 |
AB2C5D26E26 |
25.01 |
1.59 |
-8.58 |
-0.82 |
0 |
|
|
122180 |
50797001 |
1 |
ClO2N5C26H26 |
AB2C5D26E26 |
24.93 |
1.75 |
-8.39 |
-0.68 |
0 |
|
|
122181 |
50797088 |
2 |
NO3C10H10 |
AB3C10D10 |
-198.35 |
9.76 |
-8.64 |
-0.78 |
0 |
|
|
122182 |
50797094 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-90.26 |
8.33 |
-8.66 |
-0.37 |
0 |
|
|
122183 |
50797108 |
1 |
O2N5C23H29 |
A2B5C23D29 |
-10.74 |
4.99 |
-8.2 |
-0.52 |
0 |
|
|
122184 |
50797229 |
1 |
N3O4C22H23 |
A3B4C22D23 |
-131.58 |
6.36 |
-8.77 |
-0.57 |
0 |
|
|
122185 |
50797230 |
1 |
ClN3O3H16C17 |
AB3C3D16E17 |
-87.48 |
8.6 |
-8.73 |
-0.59 |
0 |
|
|
122186 |
50797231 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-92.47 |
7.59 |
-8.62 |
-0.37 |
0 |
|
|
122187 |
50797232 |
1 |
N3O6C20H23 |
A3B6C20D23 |
-190.44 |
9.46 |
-8.5 |
-0.51 |
0 |
|
|
122188 |
50797254 |
1 |
BrFN3O3H15C17 |
ABC3D3E15F17 |
-114.0 |
9.07 |
-8.81 |
-0.81 |
0 |
|
|
122189 |
50797610 |
1 |
ClN3O3C20H20 |
AB3C3D20E20 |
-71.43 |
3.73 |
-9.32 |
-1.52 |
0 |
|
|
122190 |
50797659 |
1 |
FN2O2C20H21 |
AB2C2D20E21 |
-101.23 |
5.14 |
-8.89 |
-0.29 |
0 |
|
|
122191 |
50797660 |
1 |
ClFN2O2H18C19 |
ABC2D2E18F19 |
-105.01 |
4.7 |
-8.86 |
-0.46 |
0 |
|
|
122192 |
50797661 |
2 |
NOC11H13 |
ABC11D13 |
-69.06 |
2.3 |
-8.64 |
0.0 |
0 |
|
|
122193 |
50797662 |
1 |
SN2O2C19H22 |
AB2C2D19E22 |
-55.54 |
1.75 |
-8.59 |
0.0 |
0 |
|
|
122194 |
50797663 |
1 |
ClN2O2C20H21 |
AB2C2D20E21 |
-67.15 |
2.14 |
-8.98 |
-0.49 |
0 |
|
|
122195 |
50797664 |
1 |
ClN2O3C17H17 |
AB2C3D17E17 |
-89.28 |
2.02 |
-8.95 |
-0.44 |
0 |
|
|
122196 |
50797665 |
1 |
BrFN2O2H16C18 |
ABC2D2E16F18 |
-85.0 |
3.04 |
-9.09 |
-0.44 |
0 |
|
|
122197 |
50797764 |
1 |
SN2O2C21H24 |
AB2C2D21E24 |
-55.79 |
2.61 |
-8.43 |
-0.15 |
0 |
|
|
122198 |
50797780 |
1 |
O3N5H29C31 |
A3B5C29D31 |
35.95 |
4.97 |
-8.48 |
-0.54 |
0 |
|
|
122199 |
50797781 |
1 |
FO2N5H26C30 |
AB2C5D26E30 |
27.65 |
5.66 |
-8.5 |
-0.66 |
0 |
|
|
122200 |
50797849 |
1 |
ClO3N4C19H21 |
AB3C4D19E21 |
-61.63 |
7.54 |
-9.3 |
-0.63 |
0 |
|
|
122201 |
50797876 |
1 |
FON5C28H30 |
ABC5D28E30 |
15.53 |
3.68 |
-9.07 |
-0.66 |
0 |
|
|
122202 |
50798030 |
1 |
ON6H30C31 |
AB6C30D31 |
115.19 |
3.83 |
-8.14 |
-0.57 |
0 |
|
|
122203 |
50798102 |
1 |
SO2N3C18H19 |
AB2C3D18E19 |
-11.01 |
7.5 |
-8.4 |
-0.46 |
0 |
|
|
122204 |
50798103 |
2 |
ON2C11H14 |
AB2C11D14 |
-38.28 |
8.07 |
-9.55 |
-0.34 |
0 |
|
|
122205 |
50798104 |
1 |
SO2N4C20H20 |
AB2C4D20E20 |
15.82 |
7.19 |
-9.17 |
-0.36 |
0 |
|
|
122206 |
50798105 |
2 |
N2O2C12H13 |
A2B2C12D13 |
-66.15 |
6.55 |
-8.29 |
-0.36 |
0 |
|
|
122207 |
50798132 |
1 |
ON4C30H32 |
AB4C30D32 |
42.86 |
2.81 |
-8.53 |
-1.2 |
0 |
|
|
122208 |
50798135 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-30.48 |
1.98 |
-9.07 |
-1.14 |
0 |
|
|
122209 |
50798136 |
1 |
ON4H20C27 |
AB4C20D27 |
98.79 |
5.11 |
-8.9 |
-1.35 |
0 |
|
|
122210 |
50798137 |
1 |
ON5H17C20 |
AB5C17D20 |
71.84 |
3.13 |
-9.26 |
-1.38 |
0 |
|
|
122211 |
50798138 |
1 |
ON4H24C26 |
AB4C24D26 |
63.94 |
3.94 |
-8.16 |
-1.21 |
0 |
|
|
122212 |
50798139 |
1 |
ON4C24H28 |
AB4C24D28 |
24.88 |
4.32 |
-8.69 |
-1.16 |
0 |
|
|
122213 |
50798140 |
1 |
FON4H27C28 |
ABC4D27E28 |
13.31 |
4.01 |
-8.7 |
-1.24 |
0 |
|
|
122214 |
50798141 |
1 |
ClON3H16C22 |
ABC3D16E22 |
58.7 |
2.21 |
-9.42 |
-1.26 |
0 |
|
|
122215 |
50798142 |
2 |
ON2C11H12 |
AB2C11D12 |
-6.63 |
2.89 |
-8.98 |
-1.06 |
0 |
|
|
122216 |
50798143 |
1 |
O2N3H19C28 |
A2B3C19D28 |
63.7 |
3.03 |
-9.17 |
-1.22 |
0 |
|
|
122217 |
50798144 |
1 |
FON5C28H28 |
ABC5D28E28 |
23.92 |
3.68 |
-8.5 |
-1.28 |
0 |
|
|
122218 |
50798145 |
1 |
ON4C30H32 |
AB4C30D32 |
50.51 |
3.35 |
-8.75 |
-1.14 |
0 |
|
|
122219 |
50798146 |
1 |
ON3C20H21 |
AB3C20D21 |
16.22 |
3.06 |
-9.03 |
-1.11 |
0 |
|
|
122220 |
50798153 |
1 |
FON3H16C22 |
ABC3D16E22 |
20.99 |
4.14 |
-9.36 |
-1.24 |
0 |
|
|
122221 |
50798190 |
1 |
ClON5C28H28 |
ABC5D28E28 |
58.3 |
6.13 |
-8.29 |
-1.29 |
0 |
|
|
122222 |
50798193 |
1 |
ON4C29H30 |
AB4C29D30 |
55.36 |
3.77 |
-8.95 |
-1.09 |
0 |
|
|
122223 |
50798426 |
1 |
ON5C27H29 |
AB5C27D29 |
61.73 |
3.41 |
-9.02 |
-0.59 |
0 |
|
|
122224 |
50798558 |
1 |
FSO2N4C24H25 |
ABC2D4E24F25 |
-68.13 |
3.99 |
-8.85 |
-1.19 |
0 |
|
|
122225 |
50798583 |
1 |
SO2N4H18C20 |
AB2C4D18E20 |
-2.01 |
4.53 |
-8.76 |
-1.25 |
0 |
|
|
122226 |
50798623 |
1 |
SN3O4H21C23 |
AB3C4D21E23 |
-38.48 |
6.2 |
-8.85 |
-0.88 |
0 |
|
|
122227 |
50798624 |
1 |
SN3O3H23C28 |
AB3C3D23E28 |
28.88 |
1.45 |
-8.8 |
-0.85 |
0 |
|
|
122228 |
50798625 |
1 |
SN3O3H21C23 |
AB3C3D21E23 |
-6.78 |
2.6 |
-8.73 |
-0.87 |
0 |
|
|
122229 |
50798647 |
1 |
S2N3O4H21C22 |
A2B3C4D21E22 |
-53.11 |
8.83 |
-8.76 |
-0.98 |
0 |
|
|
122230 |
50798648 |
1 |
SN3O4H23C24 |
AB3C4D23E24 |
-50.53 |
7.12 |
-8.64 |
-0.86 |
0 |
|
|
122231 |
50798649 |
1 |
SN3O4H23C24 |
AB3C4D23E24 |
-47.19 |
5.0 |
-8.84 |
-0.87 |
0 |
|
|
122232 |
50798696 |
1 |
S2N3O3H15C19 |
A2B3C3D15E19 |
12.53 |
3.99 |
-8.82 |
-1.09 |
0 |
|
|
122233 |
50798702 |
1 |
SO3N4H20C22 |
AB3C4D20E22 |
-11.61 |
4.13 |
-8.72 |
-1.23 |
0 |
|
|
122234 |
50798703 |
1 |
SCl2O3N4H16C21 |
AB2C3D4E16F21 |
-14.17 |
3.72 |
-8.53 |
-0.93 |
0 |
|
|
122235 |
50798704 |
1 |
SN4O5H22C24 |
AB4C5D22E24 |
-87.13 |
4.13 |
-8.7 |
-0.95 |
0 |
|
|
122236 |
50798721 |
1 |
ClSN3O4H18C22 |
ABC3D4E18F22 |
-42.83 |
2.52 |
-8.9 |
-0.93 |
0 |
|
|
122237 |
50798729 |
1 |
SN3O3C25H31 |
AB3C3D25E31 |
-65.3 |
5.59 |
-8.92 |
-1.02 |
0 |
|
|
122238 |
50798730 |
1 |
S2O4N5H19C20 |
A2B4C5D19E20 |
-17.71 |
5.58 |
-8.51 |
-0.88 |
0 |
|
|
122239 |
50799106 |
1 |
ClO2N4H21C23 |
AB2C4D21E23 |
2.21 |
5.77 |
-8.73 |
-0.77 |
0 |
|
|
122240 |
50799180 |
1 |
O2N5C26H27 |
A2B5C26D27 |
34.1 |
1.51 |
-8.6 |
-0.51 |
0 |
|
|
122241 |
50799230 |
2 |
ON2C10H12 |
AB2C10D12 |
-25.42 |
5.41 |
-8.71 |
-0.53 |
0 |
|
|
122242 |
50799283 |
1 |
S2N3O4C22H23 |
A2B3C4D22E23 |
-117.63 |
4.19 |
-8.88 |
-1.66 |
0 |
|
|
122243 |
50799284 |
1 |
ClS2N3O6H20C21 |
AB2C3D6E20F21 |
-179.81 |
8.06 |
-8.79 |
-1.58 |
0 |
|
|
122244 |
50799285 |
1 |
S2N3O7C23H23 |
A2B3C7D23E23 |
-231.71 |
7.76 |
-9.43 |
-1.59 |
0 |
|
|
122245 |
50799437 |
1 |
ClS2N3O6H18C20 |
AB2C3D6E18F20 |
-179.61 |
7.65 |
-8.67 |
-1.73 |
0 |
|
|
122246 |
50799438 |
1 |
ClS2N3O6H20C21 |
AB2C3D6E20F21 |
-181.42 |
7.24 |
-8.94 |
-1.67 |
0 |
|
|
122247 |
50799439 |
1 |
S2N3O6C22H23 |
A2B3C6D22E23 |
-177.05 |
7.94 |
-8.77 |
-1.56 |
0 |
|
|
122248 |
50799593 |
1 |
ClF3O3N4H18C23 |
AB3C3D4E18F23 |
-168.63 |
2.94 |
-8.78 |
-1.35 |
0 |
|
|
122249 |
50799594 |
1 |
O2F4N4H18C23 |
A2B4C4D18E23 |
-177.14 |
1.52 |
-9.0 |
-1.39 |
0 |
|
|
122250 |
50799599 |
1 |
O2F3N4H21C24 |
A2B3C4D21E24 |
-129.73 |
0.83 |
-9.55 |
-1.26 |
0 |
|
|
122251 |
50799708 |
1 |
S2N4O5C23H24 |
A2B4C5D23E24 |
-156.11 |
5.52 |
-9.11 |
-1.5 |
0 |
|
|
122252 |
50799709 |
2 |
SN2O2C9H9 |
AB2C2D9E9 |
-103.12 |
4.47 |
-9.06 |
-1.45 |
0 |
|
|
122253 |
50799710 |
1 |
S2N4O5H24C25 |
A2B4C5D24E25 |
-114.43 |
7.2 |
-8.56 |
-1.34 |
0 |
|
|
122254 |
50799828 |
1 |
ClS2O3N4H23C26 |
AB2C3D4E23F26 |
-52.64 |
5.58 |
-9.01 |
-1.42 |
0 |
|
|
122255 |
50799898 |
1 |
ClS2O3N4H23C26 |
AB2C3D4E23F26 |
-56.28 |
5.11 |
-8.93 |
-1.31 |
0 |
|
|
122256 |
50800114 |
1 |
ClN2S2O4H15C16 |
AB2C2D4E15F16 |
-120.35 |
6.04 |
-8.61 |
-1.08 |
0 |
|
|
122257 |
50800206 |
1 |
ClON5H16C18 |
ABC5D16E18 |
86.98 |
7.25 |
-8.86 |
-0.79 |
0 |
|
|
122258 |
50800243 |
1 |
N2S2O5C19H20 |
A2B2C5D19E20 |
-167.6 |
7.18 |
-8.99 |
-1.48 |
0 |
|
|
122259 |
50800347 |
1 |
O3N5C21H23 |
A3B5C21D23 |
6.59 |
5.37 |
-8.59 |
-1.1 |
0 |
|
|
122260 |
50800348 |
1 |
O2N6C21H22 |
A2B6C21D22 |
60.61 |
5.73 |
-8.44 |
-1.0 |
0 |
|
|
122261 |
50800367 |
1 |
ClN2S2O3C17H17 |
AB2C2D3E17F17 |
-94.29 |
2.44 |
-9.05 |
-0.89 |
0 |