List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
307134 |
125270105 |
1 |
N2O5C12H18 |
A2B5C12D18 |
-187.6 |
4.34 |
-10.13 |
-0.65 |
0 |
|
|
307136 |
125270146 |
1 |
ClO2N3H16C19 |
AB2C3D16E19 |
-22.18 |
5.97 |
-9.31 |
-0.63 |
0 |
|
|
307137 |
125270147 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-15.87 |
4.66 |
-8.57 |
-1.06 |
0 |
|
|
307138 |
125270154 |
1 |
SO8N9C23H35 |
AB8C9D23E35 |
-328.49 |
1.57 |
-9.36 |
-0.61 |
0 |
|
|
307139 |
125270160 |
1 |
N6O7C22H28 |
A6B7C22D28 |
-203.55 |
7.89 |
-9.88 |
-1.68 |
0 |
|
|
307140 |
125270167 |
1 |
O2N5C22H25 |
A2B5C22D25 |
-14.66 |
6.79 |
-8.68 |
-0.35 |
0 |
|
|
307141 |
125274978 |
1 |
SO2N3H19C22 |
AB2C3D19E22 |
39.76 |
3.18 |
-8.98 |
-1.97 |
0 |
|
|
307142 |
125275090 |
1 |
OSN4H16C17 |
ABC4D16E17 |
104.4 |
1.92 |
-9.31 |
-1.56 |
0 |
|
|
307143 |
125275091 |
1 |
OSN4H16C17 |
ABC4D16E17 |
107.13 |
2.41 |
-9.21 |
-1.63 |
0 |
|
|
307144 |
125275225 |
1 |
N3O4H17C18 |
A3B4C17D18 |
-109.47 |
3.41 |
-9.77 |
-1.08 |
0 |
|
|
307145 |
125275226 |
1 |
N3O4H17C18 |
A3B4C17D18 |
-105.93 |
4.37 |
-9.67 |
-0.99 |
0 |
|
|
307146 |
125275394 |
1 |
N2O3C12H12 |
A2B3C12D12 |
-52.81 |
5.25 |
-9.66 |
-2.05 |
0 |
|
|
307147 |
125275410 |
1 |
N3O3H17C19 |
A3B3C17D19 |
12.05 |
3.5 |
-8.98 |
-1.02 |
0 |
|
|
307148 |
125275420 |
1 |
ClO2N5H18C20 |
AB2C5D18E20 |
31.51 |
1.88 |
-9.37 |
-0.86 |
0 |
|
|
307149 |
125275423 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-75.88 |
5.4 |
-7.91 |
-1.74 |
0 |
|
|
307150 |
125275429 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-50.0 |
3.7 |
-8.58 |
-1.01 |
0 |
|
|
307151 |
125275495 |
2 |
ON2C9H11 |
AB2C9D11 |
7.61 |
8.01 |
-9.25 |
-1.07 |
0 |
|
|
307152 |
125275500 |
1 |
SO2N5C20H21 |
AB2C5D20E21 |
51.28 |
2.66 |
-8.91 |
-0.82 |
0 |
|
|
307153 |
125275501 |
1 |
O3N5C21H21 |
A3B5C21D21 |
-0.87 |
9.4 |
-9.58 |
-1.25 |
0 |
|
|
307154 |
125275503 |
1 |
FO2N3H14C18 |
AB2C3D14E18 |
63.49 |
10.69 |
-9.0 |
-1.61 |
0 |
|
|
307155 |
125275507 |
2 |
H3N4C5 |
A3B4C5 |
219.09 |
2.06 |
-9.98 |
-2.6 |
0 |
|
|
307156 |
125275509 |
1 |
N3O3H19C20 |
A3B3C19D20 |
3.72 |
7.3 |
-9.17 |
-1.17 |
0 |
|
|
307157 |
125275512 |
1 |
O4N5H11C12 |
A4B5C11D12 |
31.83 |
8.88 |
-9.62 |
-2.02 |
0 |
|
|
307158 |
125275524 |
1 |
SN3O3H17C19 |
AB3C3D17E19 |
-43.52 |
5.85 |
-9.09 |
-1.14 |
0 |
|
|
307159 |
125275529 |
1 |
O2N8C25H28 |
A2B8C25D28 |
29.49 |
6.03 |
-8.63 |
-0.93 |
0 |
|
|
307160 |
125275534 |
1 |
S2N3O3C10H17 |
A2B3C3D10E17 |
-75.7 |
3.66 |
-9.83 |
-1.52 |
0 |
|
|
307162 |
125275548 |
1 |
FN7C16H18 |
AB7C16D18 |
76.92 |
3.57 |
-8.74 |
-1.07 |
0 |
|
|
307163 |
125275554 |
1 |
NO12C36H45 |
AB12C36D45 |
-457.27 |
6.18 |
-8.52 |
-1.48 |
0 |
|
|
307164 |
125275565 |
2 |
NOC7H8 |
ABC7D8 |
-29.39 |
2.66 |
-9.15 |
-1.17 |
0 |
|
|
307165 |
125275567 |
1 |
ON5C17H23 |
AB5C17D23 |
15.21 |
8.45 |
-8.7 |
-0.96 |
0 |
|
|
307166 |
125275577 |
1 |
S2N3O4C24H27 |
A2B3C4D24E27 |
-100.14 |
9.54 |
-8.55 |
-1.76 |
0 |
|
|
307167 |
125275578 |
1 |
S2N3O4C24H27 |
A2B3C4D24E27 |
-95.57 |
8.39 |
-8.88 |
-1.68 |
0 |
|
|
307169 |
125275598 |
1 |
N2O5C18H30 |
A2B5C18D30 |
-254.24 |
6.27 |
-9.6 |
0.1 |
0 |
|
|
307170 |
125275600 |
1 |
FO3N4C18H19 |
AB3C4D18E19 |
-106.84 |
4.29 |
-9.43 |
-1.46 |
0 |
|
|
307171 |
125275601 |
1 |
FO3N4C18H19 |
AB3C4D18E19 |
-103.08 |
5.5 |
-9.6 |
-1.33 |
0 |
|
|
307172 |
125275602 |
1 |
FO3N4C18H19 |
AB3C4D18E19 |
-103.83 |
5.49 |
-9.67 |
-1.34 |
0 |
|
|
307173 |
125275611 |
1 |
NO16C54H55 |
AB16C54D55 |
-523.56 |
2.52 |
-8.62 |
-1.34 |
0 |
|
|
307174 |
125275616 |
1 |
FS2N3O4C22H22 |
AB2C3D4E22F22 |
-134.3 |
7.66 |
-9.14 |
-1.92 |
0 |
|
|
307175 |
125275619 |
1 |
NO2C20H23 |
AB2C20D23 |
-30.14 |
1.78 |
-9.42 |
0.08 |
0 |
|
|
307180 |
125275626 |
2 |
O3C8H13 |
A3B8C13 |
-292.88 |
4.83 |
-10.14 |
-0.29 |
0 |
|
|
307181 |
125275628 |
2 |
O3C8H13 |
A3B8C13 |
-286.34 |
5.85 |
-10.03 |
-0.24 |
0 |
|
|
307182 |
125275635 |
1 |
Si2O3C21H38 |
A2B3C21D38 |
-149.74 |
1.92 |
-8.83 |
0.72 |
0 |
|
|
307183 |
125275637 |
1 |
Si2O3C21H38 |
A2B3C21D38 |
-165.0 |
2.49 |
-8.91 |
0.61 |
0 |
|
|
307184 |
125275645 |
1 |
N5O6C10H13 |
A5B6C10D13 |
-171.77 |
7.7 |
-9.93 |
-1.78 |
0 |
|
|
307185 |
125275656 |
1 |
ON6H22C23 |
AB6C22D23 |
135.44 |
4.15 |
-8.69 |
-2.01 |
0 |
|
|
307186 |
125275662 |
2 |
NO4C14H21 |
AB4C14D21 |
-347.12 |
10.68 |
-9.48 |
-0.32 |
0 |
|
|
307187 |
125275670 |
1 |
ClO2N3H18C19 |
AB2C3D18E19 |
-11.46 |
5.12 |
-8.85 |
-1.43 |
0 |
|
|
307188 |
125275678 |
1 |
SF3O3N5C16H16 |
AB3C3D5E16F16 |
-205.89 |
7.62 |
-9.17 |
-1.26 |
0 |
|
|
307189 |
125275686 |
1 |
S2N3O4C15H19 |
A2B3C4D15E19 |
-88.03 |
4.72 |
-9.2 |
-1.88 |
0 |
|
|
307190 |
125275687 |
1 |
S2N3O4C15H19 |
A2B3C4D15E19 |
-86.32 |
11.6 |
-9.4 |
-1.94 |
0 |
|
|
307191 |
125275690 |
1 |
ON5C19H25 |
AB5C19D25 |
33.21 |
3.55 |
-8.49 |
-1.56 |
0 |
|
|
307192 |
125275699 |
1 |
ClSN3O3C16H18 |
ABC3D3E16F18 |
-89.83 |
5.57 |
-9.04 |
-1.73 |
0 |
|
|
307193 |
125275700 |
1 |
ClSN3O3C16H18 |
ABC3D3E16F18 |
-94.3 |
10.71 |
-8.64 |
-1.64 |
0 |
|
|
307194 |
125275703 |
1 |
OSN5C13H13 |
ABC5D13E13 |
68.16 |
2.94 |
-8.94 |
-0.7 |
0 |
|
|
307195 |
125275709 |
1 |
N4O4C21H22 |
A4B4C21D22 |
-21.17 |
4.88 |
-8.56 |
-0.74 |
0 |
|
|
307196 |
125275712 |
2 |
NO3C6H7 |
AB3C6D7 |
-164.39 |
3.97 |
-10.43 |
-1.59 |
0 |
|
|
307197 |
125275731 |
1 |
SO5C40H42 |
AB5C40D42 |
-49.25 |
2.76 |
-9.2 |
-0.4 |
0 |
|
|
307198 |
125275747 |
1 |
SO3N4C21H24 |
AB3C4D21E24 |
-34.58 |
4.11 |
-8.86 |
-1.85 |
0 |
|
|
307199 |
125275755 |
2 |
NO3C14H22 |
AB3C14D22 |
-233.24 |
3.63 |
-8.47 |
-0.12 |
0 |
|
|
307200 |
125275761 |
1 |
SN4O4C18H18 |
AB4C4D18E18 |
-21.14 |
10.21 |
-9.2 |
-0.79 |
0 |
|
|
307201 |
125275806 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-35.14 |
6.81 |
-8.97 |
0.38 |
0 |
|
|
307204 |
125275815 |
1 |
NO12C51H57 |
AB12C51D57 |
-364.75 |
3.8 |
-8.82 |
-0.92 |
0 |
|
|
307205 |
125276260 |
1 |
SO3N4H18C24 |
AB3C4D18E24 |
-11.91 |
5.73 |
-9.28 |
-1.46 |
0 |
|
|
307207 |
125292389 |
1 |
N4O7H12C16 |
A4B7C12D16 |
-224.59 |
8.03 |
-9.55 |
-1.38 |
0 |
|
|
307208 |
125292396 |
2 |
NO2H7C8 |
AB2C7D8 |
-126.95 |
4.51 |
-8.84 |
-0.6 |
0 |
|
|
307209 |
125292397 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-91.02 |
7.54 |
-8.83 |
-0.87 |
0 |
|
|
307210 |
125292398 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-90.87 |
2.91 |
-9.0 |
-1.04 |
0 |
|
|
307211 |
125292401 |
1 |
NO7H19C27 |
AB7C19D27 |
-169.99 |
8.14 |
-8.74 |
-1.89 |
0 |
|
|
307212 |
125292403 |
1 |
ClFN3O3H23C29 |
ABC3D3E23F29 |
-54.09 |
9.08 |
-7.13 |
-2.39 |
0 |
|
|
307213 |
125292409 |
1 |
N3O3H29C30 |
A3B3C29D30 |
-8.24 |
3.68 |
-8.77 |
-0.94 |
0 |
|
|
307214 |
125292428 |
1 |
N3O6C27H35 |
A3B6C27D35 |
-181.12 |
5.2 |
-9.06 |
-1.14 |
0 |
|
|
307215 |
125292473 |
1 |
ClN2O7H23C29 |
AB2C7D23E29 |
-178.22 |
2.82 |
-8.96 |
-1.36 |
0 |
|
|
307216 |
125292493 |
1 |
SO2N4C22H26 |
AB2C4D22E26 |
-23.48 |
6.21 |
-9.12 |
-1.48 |
0 |
|
|
307219 |
125292538 |
1 |
N3O6C30H37 |
A3B6C30D37 |
-190.39 |
1.9 |
-8.49 |
-0.92 |
0 |
|
|
307220 |
125292573 |
1 |
NOC11H11 |
ABC11D11 |
15.68 |
5.13 |
-9.26 |
-1.4 |
0 |