List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
132108 |
51306451 |
1 |
N2O5C21H30 |
A2B5C21D30 |
-200.06 |
5.67 |
-8.6 |
-0.29 |
0 |
|
|
132109 |
51306955 |
1 |
OSN4C20H22 |
ABC4D20E22 |
37.1 |
5.85 |
-9.04 |
-0.61 |
0 |
|
|
132110 |
51307467 |
1 |
ClO2N4C20H27 |
AB2C4D20E27 |
-63.73 |
6.74 |
-8.77 |
0.07 |
0 |
|
|
132111 |
51308723 |
1 |
O3N4C20H20 |
A3B4C20D20 |
-59.06 |
3.57 |
-9.2 |
-0.88 |
0 |
|
|
132112 |
51308864 |
1 |
ClON4C18H23 |
ABC4D18E23 |
2.08 |
4.55 |
-8.66 |
0.02 |
0 |
|
|
132113 |
51310029 |
1 |
N2O4C21H22 |
A2B4C21D22 |
-107.38 |
6.95 |
-8.04 |
-0.64 |
0 |
|
|
132114 |
51310128 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-3.61 |
4.84 |
-9.22 |
-0.89 |
0 |
|
|
132115 |
51310363 |
1 |
N3O5C16H19 |
A3B5C16D19 |
-151.75 |
2.83 |
-8.27 |
-0.55 |
0 |
|
|
132116 |
51310611 |
1 |
ClO2N3C21H26 |
AB2C3D21E26 |
-69.31 |
3.23 |
-8.24 |
-0.37 |
0 |
|
|
132117 |
51310612 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-12.55 |
2.6 |
-8.25 |
-0.63 |
0 |
|
|
132118 |
51310613 |
1 |
SO2N3C19H25 |
AB2C3D19E25 |
-54.99 |
4.72 |
-8.25 |
0.01 |
0 |
|
|
132119 |
51310614 |
1 |
ClO2N3C22H24 |
AB2C3D22E24 |
-21.21 |
1.38 |
-8.27 |
-0.85 |
0 |
|
|
132120 |
51310630 |
3 |
NOC7H9 |
ABC7D9 |
-68.82 |
5.25 |
-8.96 |
-0.56 |
0 |
|
|
132121 |
51310675 |
1 |
N3O4C21H21 |
A3B4C21D21 |
-74.53 |
3.93 |
-8.7 |
-0.48 |
0 |
|
|
132122 |
51310714 |
1 |
O3N4C21H22 |
A3B4C21D22 |
-41.17 |
7.57 |
-8.8 |
-0.54 |
0 |
|
|
132123 |
51310785 |
1 |
O3N4C17H26 |
A3B4C17D26 |
-118.52 |
6.01 |
-9.24 |
-0.11 |
0 |
|
|
132124 |
51310970 |
1 |
NO2F3H18C19 |
AB2C3D18E19 |
-213.01 |
2.81 |
-8.82 |
-0.63 |
0 |
|
|
132125 |
51311128 |
1 |
SN2O2F3C17H17 |
AB2C2D3E17F17 |
-212.2 |
5.61 |
-9.4 |
-0.57 |
0 |
|
|
132126 |
51311129 |
1 |
NOSF3H14C17 |
ABCD3E14F17 |
-162.73 |
3.95 |
-8.88 |
-0.54 |
0 |
|
|
132127 |
51311130 |
1 |
N2O2F3C19H19 |
A2B2C3D19E19 |
-214.2 |
3.74 |
-9.72 |
-0.72 |
0 |
|
|
132128 |
51311156 |
2 |
FON2H8C9 |
ABC2D8E9 |
-113.44 |
4.26 |
-9.05 |
-0.97 |
0 |
|
|
132129 |
51311157 |
1 |
F2O2N4H18C19 |
A2B2C4D18E19 |
-120.76 |
5.38 |
-8.94 |
-0.9 |
0 |
|
|
132130 |
51311227 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-104.77 |
6.01 |
-8.88 |
-0.35 |
0 |
|
|
132131 |
51311316 |
1 |
NF2O2H17C18 |
AB2C2D17E18 |
-145.21 |
2.98 |
-8.83 |
-0.42 |
0 |
|
|
132132 |
51311407 |
1 |
NO3C17H21 |
AB3C17D21 |
-87.83 |
3.72 |
-8.8 |
-0.46 |
0 |
|
|
132133 |
51311408 |
1 |
ON4C17H24 |
AB4C17D24 |
-16.86 |
8.79 |
-8.79 |
-0.53 |
0 |
|
|
132134 |
51311409 |
1 |
ClN2O2C16H23 |
AB2C2D16E23 |
-113.47 |
6.02 |
-9.68 |
-0.5 |
0 |
|
|
132135 |
51311633 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-135.5 |
4.49 |
-8.8 |
-0.02 |
0 |
|
|
132136 |
51312567 |
1 |
F2N3O3C18H21 |
A2B3C3D18E21 |
-189.56 |
2.23 |
-9.27 |
-1.08 |
0 |
|
|
132137 |
51312568 |
1 |
Cl2N3O3C18H21 |
A2B3C3D18E21 |
-115.63 |
3.49 |
-9.44 |
-1.18 |
0 |
|
|
132138 |
51312574 |
1 |
FO3N4C16H23 |
AB3C4D16E23 |
-175.16 |
5.59 |
-9.69 |
-0.19 |
0 |
|
|
132139 |
51312575 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
-25.05 |
3.13 |
-8.69 |
-1.05 |
0 |
|
|
132140 |
51312605 |
2 |
FNOC11H11 |
ABCD11E11 |
-120.08 |
1.06 |
-9.37 |
-1.08 |
0 |
|
|
132141 |
51312727 |
1 |
O2S2N3C13H15 |
A2B2C3D13E15 |
-36.72 |
5.62 |
-8.78 |
-0.34 |
0 |
|
|
132142 |
51312825 |
1 |
O3N4C21H24 |
A3B4C21D24 |
-20.7 |
6.27 |
-8.16 |
-0.71 |
0 |
|
|
132143 |
51313318 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-90.61 |
4.65 |
-8.28 |
-0.01 |
0 |
|
|
132144 |
51313377 |
1 |
N3O4C19H25 |
A3B4C19D25 |
-150.59 |
2.36 |
-8.83 |
-0.41 |
0 |
|
|
132145 |
51313525 |
1 |
FSN2O2C20H21 |
ABC2D2E20F21 |
-104.68 |
3.23 |
-8.58 |
-0.4 |
0 |
|
|
132146 |
51313526 |
1 |
SN2O4C20H20 |
AB2C4D20E20 |
-105.28 |
8.08 |
-9.52 |
-1.34 |
0 |
|
|
132147 |
51313666 |
1 |
OSN3C17H21 |
ABC3D17E21 |
3.41 |
2.27 |
-8.73 |
-0.25 |
0 |
|
|
132148 |
51313667 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-99.32 |
1.47 |
-8.93 |
-0.29 |
0 |
|
|
132149 |
51313726 |
1 |
ClN2O3C21H21 |
AB2C3D21E21 |
-62.31 |
5.26 |
-8.88 |
-1.01 |
0 |
|
|
132150 |
51314244 |
1 |
ClO3N4C14H21 |
AB3C4D14E21 |
-121.3 |
4.08 |
-9.6 |
-0.27 |
0 |
|
|
132151 |
51314245 |
1 |
N3O4C20H25 |
A3B4C20D25 |
-138.79 |
3.16 |
-9.21 |
-0.8 |
0 |
|
|
132152 |
51314364 |
1 |
FO2N5C20H22 |
AB2C5D20E22 |
-75.48 |
4.17 |
-8.87 |
-0.32 |
0 |
|
|
132153 |
51314365 |
1 |
SN3O3C21H21 |
AB3C3D21E21 |
-48.55 |
5.78 |
-9.25 |
-1.15 |
0 |
|
|
132154 |
51314477 |
2 |
ON3H9C10 |
AB3C9D10 |
31.43 |
2.9 |
-8.09 |
-0.97 |
0 |
|
|
132155 |
51314575 |
1 |
SF2O2N5H13C16 |
AB2C2D5E13F16 |
-47.06 |
7.72 |
-9.58 |
-1.19 |
0 |
|
|
132156 |
51314609 |
1 |
FO2N4C22H27 |
AB2C4D22E27 |
-90.88 |
2.13 |
-8.77 |
-0.38 |
0 |
|
|
132157 |
51314610 |
1 |
O2N3C23H29 |
A2B3C23D29 |
-55.14 |
4.57 |
-8.59 |
-0.05 |
0 |
|
|
132158 |
51314611 |
2 |
ON2H10C11 |
AB2C10D11 |
32.92 |
2.63 |
-9.23 |
-0.99 |
0 |
|
|
132159 |
51314612 |
1 |
O2N7C19H19 |
A2B7C19D19 |
48.15 |
4.82 |
-9.42 |
-1.02 |
0 |
|
|
132160 |
51314613 |
1 |
O2N4H22C23 |
A2B4C22D23 |
21.1 |
7.2 |
-9.21 |
-1.29 |
0 |
|
|
132161 |
51314792 |
1 |
SO2N4C18H18 |
AB2C4D18E18 |
-11.84 |
4.64 |
-8.66 |
-0.91 |
0 |
|
|
132162 |
51314908 |
1 |
N2O2S2H12C15 |
A2B2C2D12E15 |
37.94 |
4.55 |
-8.56 |
-1.4 |
0 |
|
|
132163 |
51315160 |
1 |
N2O3C21H26 |
A2B3C21D26 |
-107.92 |
2.83 |
-8.78 |
0.02 |
0 |
|
|
132164 |
51315161 |
1 |
ClFSO2N3H13C17 |
ABCD2E3F13G17 |
-38.87 |
4.41 |
-9.35 |
-1.48 |
0 |
|
|
132165 |
51315162 |
1 |
ClFSO2N3H15C17 |
ABCD2E3F15G17 |
-60.06 |
5.72 |
-9.5 |
-1.2 |
0 |
|
|
132166 |
51315163 |
1 |
ClFO2N3H19C21 |
ABC2D3E19F21 |
-37.95 |
6.1 |
-8.94 |
-0.79 |
0 |
|
|
132167 |
51315164 |
1 |
ClFN2O2H20C21 |
ABC2D2E20F21 |
-78.01 |
6.65 |
-8.76 |
-0.44 |
0 |
|
|
132168 |
51315165 |
1 |
FSN3O3H12C18 |
ABC3D3E12F18 |
-2.39 |
3.97 |
-9.26 |
-1.33 |
0 |
|
|
132169 |
51315505 |
2 |
ON2C9H11 |
AB2C9D11 |
-34.49 |
7.45 |
-9.43 |
-0.36 |
0 |
|
|
132170 |
51315516 |
1 |
ClN3O5C17H20 |
AB3C5D17E20 |
-192.29 |
4.99 |
-9.23 |
-0.8 |
0 |
|
|
132171 |
51315517 |
1 |
SN3O3C16H19 |
AB3C3D16E19 |
-112.75 |
5.44 |
-9.07 |
-0.54 |
0 |
|
|
132172 |
51315518 |
1 |
N4O5C18H20 |
A4B5C18D20 |
-178.44 |
2.71 |
-10.05 |
-0.33 |
0 |
|
|
132173 |
51315571 |
1 |
BrFN3O3H13C14 |
ABC3D3E13F14 |
-146.74 |
3.43 |
-10.03 |
-0.98 |
0 |
|
|
132174 |
51315667 |
1 |
SN2O4C15H20 |
AB2C4D15E20 |
-146.7 |
7.89 |
-8.96 |
-0.25 |
0 |
|
|
132175 |
51315740 |
1 |
OSN4C20H24 |
ABC4D20E24 |
22.99 |
5.88 |
-9.02 |
-0.65 |
0 |
|
|
132176 |
51315744 |
1 |
ClO2N5C18H28 |
AB2C5D18E28 |
-68.38 |
7.5 |
-8.8 |
-0.15 |
0 |
|
|
132177 |
51315745 |
1 |
SO2N3C21H29 |
AB2C3D21E29 |
-74.77 |
6.6 |
-8.57 |
-0.08 |
0 |
|
|
132178 |
51315746 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-60.47 |
1.93 |
-8.58 |
0.29 |
0 |
|
|
132179 |
51315747 |
1 |
N2O3C24H26 |
A2B3C24D26 |
-60.71 |
0.87 |
-8.6 |
-0.82 |
0 |
|
|
132180 |
51315760 |
1 |
ClO3N4C18H21 |
AB3C4D18E21 |
-62.79 |
5.21 |
-8.93 |
-0.42 |
0 |
|
|
132181 |
51315778 |
1 |
ClN3O4H16C19 |
AB3C4D16E19 |
-21.22 |
6.47 |
-9.24 |
-1.74 |
0 |
|
|
132182 |
51316397 |
1 |
SN2O2C20H20 |
AB2C2D20E20 |
-36.32 |
3.9 |
-8.91 |
-0.89 |
0 |
|
|
132183 |
51316419 |
1 |
N2O2C21H28 |
A2B2C21D28 |
-58.28 |
6.71 |
-9.36 |
0.02 |
0 |
|
|
132184 |
51316423 |
1 |
NSO3C20H23 |
ABC3D20E23 |
-84.49 |
4.68 |
-9.35 |
-0.23 |
0 |
|
|
132185 |
51317802 |
1 |
N3O4C21H31 |
A3B4C21D31 |
-159.95 |
3.02 |
-8.9 |
-0.03 |
0 |
|
|
132186 |
51317966 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-116.66 |
8.1 |
-7.99 |
0.0 |
0 |
|
|
132187 |
51317967 |
1 |
ClN2O4C20H21 |
AB2C4D20E21 |
-134.15 |
4.6 |
-8.14 |
-0.38 |
0 |
|
|
132188 |
51318051 |
1 |
FOSN4H17C18 |
ABCD4E17F18 |
1.33 |
7.83 |
-8.92 |
-0.52 |
0 |
|
|
132189 |
51318052 |
1 |
OSN5C12H19 |
ABC5D12E19 |
4.53 |
4.95 |
-9.1 |
-0.29 |
0 |
|
|
132190 |
51318054 |
1 |
ClFOSN4C13H14 |
ABCDE4F13G14 |
-40.32 |
6.69 |
-8.78 |
-0.58 |
0 |
|
|
132191 |
51318063 |
1 |
SO2N4C14H18 |
AB2C4D14E18 |
-22.29 |
4.71 |
-8.35 |
-0.18 |
0 |
|
|
132192 |
51318120 |
1 |
ClOSN4H13C14 |
ABCD4E13F14 |
52.38 |
4.88 |
-8.81 |
-0.98 |
0 |
|
|
132193 |
51318131 |
1 |
OSN4C17H22 |
ABC4D17E22 |
9.07 |
6.93 |
-8.72 |
-0.06 |
0 |
|
|
132194 |
51318397 |
1 |
FNS2O3H14C17 |
ABC2D3E14F17 |
-76.87 |
6.1 |
-8.79 |
-0.9 |
0 |
|
|
132195 |
51318652 |
1 |
N2S2O4C17H18 |
A2B2C4D17E18 |
-112.23 |
5.11 |
-8.27 |
-1.03 |
0 |
|
|
132196 |
51318653 |
1 |
SN2O3C21H28 |
AB2C3D21E28 |
-136.85 |
3.38 |
-8.21 |
0.01 |
0 |
|
|
132197 |
51319297 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-32.87 |
4.61 |
-7.96 |
-0.39 |
0 |
|
|
132198 |
51319369 |
1 |
SO2N5C19H21 |
AB2C5D19E21 |
21.35 |
2.18 |
-8.91 |
-0.64 |
0 |
|
|
132199 |
51319612 |
2 |
NO2H9C10 |
AB2C9D10 |
-105.67 |
3.02 |
-8.67 |
-1.01 |
0 |
|
|
132200 |
51319744 |
1 |
FOSN5H14C15 |
ABCD5E14F15 |
8.38 |
2.47 |
-8.95 |
-1.14 |
0 |
|
|
132201 |
51319745 |
1 |
ClSO3N6H13C15 |
ABC3D6E13F15 |
44.74 |
6.92 |
-9.5 |
-1.58 |
0 |
|
|
132202 |
51320159 |
1 |
ClOSN3C16H18 |
ABCD3E16F18 |
10.59 |
3.46 |
-9.0 |
-0.61 |
0 |
|
|
132203 |
51320191 |
1 |
SN2O4H18C20 |
AB2C4D18E20 |
-97.32 |
6.14 |
-8.94 |
-0.72 |
0 |
|
|
132204 |
51320192 |
1 |
NSO6C19H19 |
ABC6D19E19 |
-209.69 |
8.83 |
-9.29 |
-0.98 |
0 |
|
|
132205 |
51320193 |
1 |
FNSO4H16C17 |
ABCD4E16F17 |
-171.15 |
8.65 |
-9.06 |
-0.82 |
0 |
|
|
132206 |
51320194 |
1 |
NSO4C18H19 |
ABC4D18E19 |
-137.04 |
8.39 |
-8.69 |
-0.79 |
0 |
|
|
132207 |
51320195 |
1 |
NSO4C18H19 |
ABC4D18E19 |
-135.75 |
8.84 |
-8.82 |
-0.8 |
0 |