List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
67151 |
46505962 |
1 |
N4O6C23H24 |
A4B6C23D24 |
-105.02 |
5.72 |
-8.7 |
-1.12 |
0 |
|
|
67152 |
46505963 |
1 |
N3O6C20H25 |
A3B6C20D25 |
-220.21 |
4.77 |
-8.53 |
-0.67 |
0 |
|
|
67153 |
46505964 |
1 |
N3O7H19C20 |
A3B7C19D20 |
-144.44 |
8.7 |
-8.57 |
-1.26 |
0 |
|
|
67154 |
46505965 |
1 |
N3O4C30H43 |
A3B4C30D43 |
-211.84 |
6.64 |
-9.6 |
-0.56 |
0 |
|
|
67155 |
46505967 |
1 |
O2N3C32H51 |
A2B3C32D51 |
-143.15 |
7.13 |
-8.67 |
-0.27 |
0 |
|
|
67156 |
46505973 |
1 |
N2O3C25H36 |
A2B3C25D36 |
-153.71 |
3.78 |
-9.48 |
-0.11 |
0 |
|
|
67157 |
46505975 |
1 |
O2N3C32H49 |
A2B3C32D49 |
-137.98 |
4.03 |
-8.39 |
-0.35 |
0 |
|
|
67158 |
46505977 |
1 |
O2N4C31H48 |
A2B4C31D48 |
-117.71 |
2.44 |
-8.56 |
-0.09 |
0 |
|
|
67159 |
46505980 |
1 |
O2N3C33H41 |
A2B3C33D41 |
-80.91 |
5.78 |
-8.53 |
-0.36 |
0 |
|
|
67160 |
46505981 |
2 |
ON2C17H22 |
AB2C17D22 |
-70.57 |
3.78 |
-8.31 |
-0.38 |
0 |
|
|
67161 |
46505982 |
2 |
NOC15H19 |
ABC15D19 |
-75.73 |
3.06 |
-9.22 |
-0.12 |
0 |
|
|
67162 |
46505984 |
2 |
ON2C17H18 |
AB2C17D18 |
-23.37 |
6.17 |
-8.72 |
-0.33 |
0 |
|
|
67163 |
46505985 |
1 |
O2N3C29H37 |
A2B3C29D37 |
-81.95 |
4.42 |
-9.65 |
-0.21 |
0 |
|
|
67164 |
46505987 |
1 |
O2N3C29H37 |
A2B3C29D37 |
-88.23 |
1.54 |
-9.25 |
-0.33 |
0 |
|
|
67165 |
46505992 |
1 |
O2N3C31H47 |
A2B3C31D47 |
-134.85 |
4.78 |
-8.68 |
-0.24 |
0 |
|
|
67166 |
46505993 |
1 |
N2O2C31H46 |
A2B2C31D46 |
-148.02 |
1.49 |
-9.53 |
-0.25 |
0 |
|
|
67167 |
46505995 |
1 |
N2O3C24H34 |
A2B3C24D34 |
-150.22 |
4.84 |
-8.7 |
-0.24 |
0 |
|
|
67168 |
46505996 |
1 |
N3O4C30H45 |
A3B4C30D45 |
-207.95 |
5.29 |
-8.64 |
-0.2 |
0 |
|
|
67169 |
46505999 |
1 |
N3O3C32H39 |
A3B3C32D39 |
-105.71 |
3.35 |
-8.7 |
-0.25 |
0 |
|
|
67170 |
46506001 |
1 |
N2O3H18C21 |
A2B3C18D21 |
-48.02 |
2.63 |
-8.73 |
-1.94 |
0 |
|
|
67171 |
46506002 |
1 |
N2O4H18C21 |
A2B4C18D21 |
-85.59 |
1.12 |
-8.8 |
-1.91 |
0 |
|
|
67172 |
46506004 |
2 |
NO2H8C10 |
AB2C8D10 |
-75.32 |
1.68 |
-8.88 |
-1.74 |
0 |
|
|
67173 |
46506005 |
2 |
NO2H8C10 |
AB2C8D10 |
-71.76 |
2.63 |
-8.32 |
-1.99 |
0 |
|
|
67174 |
46506006 |
1 |
N3O5H13C19 |
A3B5C13D19 |
-35.46 |
6.72 |
-9.49 |
-2.2 |
0 |
|
|
67175 |
46506007 |
1 |
N2F3O3H11C19 |
A2B3C3D11E19 |
-199.63 |
4.88 |
-9.28 |
-2.25 |
0 |
|
|
67176 |
46506008 |
1 |
N2O4H16C21 |
A2B4C16D21 |
-88.34 |
4.18 |
-9.6 |
-2.1 |
0 |
|
|
67177 |
46506010 |
2 |
NO3H8C11 |
AB3C8D11 |
-159.4 |
2.67 |
-9.76 |
-2.01 |
0 |
|
|
67178 |
46506011 |
2 |
NO2F3H7C11 |
AB2C3D7E11 |
-396.14 |
4.28 |
-9.43 |
-2.21 |
0 |
|
|
67179 |
46506013 |
1 |
O6N7C21H21 |
A6B7C21D21 |
41.29 |
8.71 |
-9.45 |
-1.38 |
0 |
|
|
67180 |
46506014 |
2 |
N3O3C11H11 |
A3B3C11D11 |
29.84 |
4.76 |
-9.31 |
-1.3 |
0 |
|
|
67181 |
46506016 |
1 |
O3N4C19H20 |
A3B4C19D20 |
1.69 |
8.63 |
-8.86 |
-0.84 |
0 |
|
|
67182 |
46506017 |
1 |
O6N7C22H23 |
A6B7C22D23 |
20.54 |
13.25 |
-9.49 |
-1.42 |
0 |
|
|
67183 |
46506018 |
1 |
S2N3O6C27H33 |
A2B3C6D27E33 |
-143.84 |
4.53 |
-8.3 |
-1.2 |
0 |
|
|
67184 |
46506019 |
1 |
ClSN2O3C21H23 |
ABC2D3E21F23 |
-74.12 |
2.88 |
-9.14 |
-1.32 |
0 |
|
|
67185 |
46506023 |
1 |
N4O5C20H24 |
A4B5C20D24 |
-187.08 |
3.04 |
-8.94 |
-0.62 |
0 |
|
|
67186 |
46506025 |
1 |
N3O7C21H21 |
A3B7C21D21 |
-152.4 |
10.19 |
-8.7 |
-1.16 |
1 |
|
|
67187 |
46506027 |
1 |
ClN3O3H19C22 |
AB3C3D19E22 |
-37.02 |
4.55 |
0.0 |
0.0 |
1 |
|
|
67188 |
46506030 |
1 |
ClO2N3H15C16 |
AB2C3D15E16 |
-27.19 |
4.15 |
0.0 |
0.0 |
1 |
|
|
67189 |
46506031 |
1 |
ClN3O3H21C23 |
AB3C3D21E23 |
-44.04 |
1.48 |
0.0 |
0.0 |
1 |
|
|
67190 |
46506032 |
1 |
ClFO2N3H16C21 |
ABC2D3E16F21 |
-43.74 |
2.73 |
0.0 |
0.0 |
1 |
|
|
67191 |
46506033 |
1 |
BrClO2N3H16C21 |
ABC2D3E16F21 |
5.49 |
2.73 |
0.0 |
0.0 |
1 |
|
|
67192 |
46506035 |
1 |
BrClO2N3H18C22 |
ABC2D3E18F22 |
-5.0 |
4.57 |
0.0 |
0.0 |
0 |
|
|
67193 |
46506036 |
1 |
SN5O5H21C24 |
AB5C5D21E24 |
-53.64 |
9.16 |
-8.93 |
-1.52 |
0 |
|
|
67194 |
46506038 |
1 |
SF3O3N4H19C20 |
AB3C3D4E19F20 |
-239.37 |
5.38 |
-8.56 |
-1.34 |
0 |
|
|
67195 |
46506039 |
1 |
ClSO3N4C20H21 |
ABC3D4E20F21 |
-89.4 |
7.66 |
-8.88 |
-1.32 |
0 |
|
|
67196 |
46506041 |
1 |
S2N4O5C17H18 |
A2B4C5D17E18 |
-161.66 |
7.29 |
-9.18 |
-1.3 |
0 |
|
|
67197 |
46506043 |
1 |
SN4O5C18H24 |
AB4C5D18E24 |
-208.55 |
3.41 |
-9.06 |
-1.17 |
0 |
|
|
67198 |
46506045 |
1 |
SN4O5C17H22 |
AB4C5D17E22 |
-205.82 |
4.88 |
-9.18 |
-1.35 |
0 |
|
|
67199 |
46506046 |
1 |
SN3O3C19H21 |
AB3C3D19E21 |
-102.0 |
8.19 |
-9.22 |
-1.47 |
0 |
|
|
67200 |
46506047 |
1 |
SN3O4C17H17 |
AB3C4D17E17 |
-122.07 |
5.65 |
-8.78 |
-1.28 |
0 |
|
|
67201 |
46506048 |
1 |
SN3O3C14H19 |
AB3C3D14E19 |
-129.04 |
6.22 |
-9.17 |
-1.27 |
0 |
|
|
67202 |
46506051 |
1 |
SN3O3C12H13 |
AB3C3D12E13 |
-87.72 |
6.96 |
-9.19 |
-1.29 |
0 |
|
|
67203 |
46506054 |
1 |
SN3O5C16H23 |
AB3C5D16E23 |
-215.99 |
5.95 |
-9.2 |
-1.3 |
0 |
|
|
67204 |
46506059 |
1 |
BrClSN3O4C24H27 |
ABCD3E4F24G27 |
-122.95 |
3.15 |
-8.9 |
-0.99 |
0 |
|
|
67205 |
46506061 |
1 |
BrSN2O4C22H29 |
ABC2D4E22F29 |
-161.56 |
10.65 |
-8.85 |
-1.01 |
0 |
|
|
67206 |
46506062 |
1 |
BrSN3O4C20H22 |
ABC3D4E20F22 |
-118.28 |
2.42 |
-9.06 |
-1.0 |
0 |
|
|
67207 |
46506064 |
1 |
BrSN2O4C18H25 |
ABC2D4E18F25 |
-169.29 |
6.91 |
-8.95 |
-0.77 |
0 |
|
|
67208 |
46506066 |
1 |
BrClSN2O4C22H24 |
ABCD2E4F22G24 |
-141.55 |
11.26 |
-9.14 |
-1.1 |
0 |
|
|
67209 |
46506067 |
1 |
BrSN2O4C21H29 |
ABC2D4E21F29 |
-174.52 |
11.15 |
-9.13 |
-0.98 |
0 |
|
|
67210 |
46506068 |
1 |
BrSN2O4C19H25 |
ABC2D4E19F25 |
-161.62 |
6.88 |
-9.0 |
-0.76 |
0 |
|
|
67211 |
46506069 |
1 |
BrSN2O6C24H29 |
ABC2D6E24F29 |
-228.53 |
5.91 |
-8.55 |
-0.36 |
0 |
|
|
67212 |
46506072 |
1 |
BrSN2O4C22H25 |
ABC2D4E22F25 |
-134.86 |
6.96 |
-8.62 |
-0.84 |
0 |
|
|
67213 |
46506073 |
1 |
BrSN3O6C21H28 |
ABC3D6E21F28 |
-241.97 |
4.61 |
-9.09 |
-1.02 |
0 |
|
|
67214 |
46506077 |
1 |
BrSN2O5C19H21 |
ABC2D5E19F21 |
-156.4 |
11.46 |
-9.13 |
-1.05 |
0 |
|
|
67215 |
46506078 |
1 |
BrSN2O4C20H27 |
ABC2D4E20F27 |
-158.27 |
6.54 |
-8.96 |
-0.72 |
0 |
|
|
67216 |
46506079 |
1 |
BrSN2O4C22H23 |
ABC2D4E22F23 |
-117.46 |
7.13 |
-8.49 |
-0.82 |
0 |
|
|
67217 |
46506081 |
1 |
BrSN2O4C20H27 |
ABC2D4E20F27 |
-166.02 |
5.78 |
-8.91 |
-0.73 |
0 |
|
|
67218 |
46506082 |
1 |
BrSN2O4C20H27 |
ABC2D4E20F27 |
-164.84 |
5.58 |
-8.93 |
-0.75 |
0 |
|
|
67219 |
46506083 |
1 |
BrSN2O5C22H25 |
ABC2D5E22F25 |
-165.69 |
7.24 |
-8.26 |
-0.82 |
0 |
|
|
67220 |
46506084 |
1 |
FSBr2N2O4H19C20 |
ABC2D2E4F19G20 |
-161.81 |
10.23 |
-9.08 |
-0.95 |
0 |
|
|
67221 |
46506085 |
1 |
BrClSN3O4C24H27 |
ABCD3E4F24G27 |
-125.87 |
8.81 |
-8.5 |
-0.89 |
0 |
|
|
67222 |
46506086 |
1 |
BrSN3O4C26H32 |
ABC3D4E26F32 |
-129.66 |
8.79 |
-8.69 |
-0.8 |
0 |
|
|
67223 |
46506087 |
1 |
BrSN2O4C23H25 |
ABC2D4E23F25 |
-128.63 |
7.17 |
-8.63 |
-0.75 |
0 |
|
|
67224 |
46506092 |
1 |
BrSN2O6C18H25 |
ABC2D6E18F25 |
-235.28 |
7.28 |
-9.0 |
-0.76 |
0 |
|
|
67225 |
46506096 |
1 |
BrSN3O4C25H30 |
ABC3D4E25F30 |
-116.38 |
11.94 |
-8.65 |
-0.99 |
0 |
|
|
67226 |
46506098 |
1 |
BrSN2O4C26H31 |
ABC2D4E26F31 |
-134.15 |
6.09 |
-8.92 |
-0.82 |
0 |
|
|
67227 |
46506099 |
1 |
BrSN2O4C23H27 |
ABC2D4E23F27 |
-140.51 |
7.16 |
-8.96 |
-0.83 |
0 |
|
|
67228 |
46506100 |
1 |
BrFSN2O4C21H22 |
ABCD2E4F21G22 |
-175.38 |
13.47 |
-9.23 |
-1.1 |
0 |
|
|
67229 |
46506102 |
1 |
BrSN2O6C21H27 |
ABC2D6E21F27 |
-236.82 |
5.99 |
-8.97 |
-0.72 |
0 |
|
|
67230 |
46506104 |
1 |
BrFSN3O4C24H27 |
ABCD3E4F24G27 |
-161.16 |
8.68 |
-8.58 |
-0.85 |
0 |
|
|
67231 |
46506108 |
1 |
BrSN3O6C22H30 |
ABC3D6E22F30 |
-260.77 |
8.27 |
-9.21 |
-1.07 |
0 |
|
|
67232 |
46506109 |
1 |
BrSN3O6C26H30 |
ABC3D6E26F30 |
-184.09 |
4.13 |
-8.79 |
-1.03 |
0 |
|
|
67233 |
46506110 |
1 |
BrClSN2O5C21H22 |
ABCD2E5F21G22 |
-163.49 |
9.1 |
-8.29 |
-0.87 |
0 |
|
|
67234 |
46506112 |
1 |
BrSN2O5C19H27 |
ABC2D5E19F27 |
-208.0 |
12.16 |
-9.32 |
-1.12 |
0 |
|
|
67235 |
46506113 |
1 |
BrSN3O5C25H30 |
ABC3D5E25F30 |
-152.68 |
8.08 |
-7.83 |
-0.87 |
0 |
|
|
67236 |
46506115 |
1 |
BrSN2O6C22H23 |
ABC2D6E22F23 |
-225.43 |
2.2 |
-8.92 |
-1.0 |
0 |
|
|
67237 |
46506117 |
1 |
BrSN2O5C18H25 |
ABC2D5E18F25 |
-194.08 |
11.3 |
-9.17 |
-0.93 |
0 |
|
|
67238 |
46506118 |
1 |
BrSN2O5C20H29 |
ABC2D5E20F29 |
-209.85 |
9.95 |
-9.12 |
-0.87 |
0 |
|
|
67239 |
46506121 |
1 |
BrSN2O6C21H31 |
ABC2D6E21F31 |
-259.29 |
8.11 |
-9.15 |
-1.03 |
0 |
|
|
67240 |
46506122 |
1 |
BrSN2O4C22H33 |
ABC2D4E22F33 |
-185.71 |
6.32 |
-8.95 |
-0.78 |
0 |
|
|
67241 |
46506123 |
1 |
BrSN2F3O5H20C21 |
ABC2D3E5F20G21 |
-325.32 |
8.54 |
-9.1 |
-0.95 |
0 |
|
|
67242 |
46506124 |
1 |
BrSN2O6C24H29 |
ABC2D6E24F29 |
-214.14 |
7.49 |
-8.2 |
-0.85 |
0 |
|
|
67243 |
46506125 |
1 |
BrSN2O4C23H27 |
ABC2D4E23F27 |
-127.66 |
7.09 |
-9.0 |
-0.76 |
0 |
|
|
67244 |
46506126 |
1 |
BrSN3O4C25H32 |
ABC3D4E25F32 |
-145.06 |
13.02 |
-7.66 |
-0.95 |
0 |
|
|
67245 |
46506129 |
1 |
BrClSN2O4C20H20 |
ABCD2E4F20G20 |
-131.64 |
7.01 |
-9.06 |
-0.91 |
0 |
|
|
67246 |
46506133 |
1 |
BrSN2O4C18H25 |
ABC2D4E18F25 |
-162.07 |
5.53 |
-8.93 |
-0.74 |
0 |
|
|
67247 |
46506134 |
1 |
BrSN2O4C19H25 |
ABC2D4E19F25 |
-160.16 |
2.7 |
-9.02 |
-0.94 |
0 |
|
|
67248 |
46506136 |
1 |
SBr2N2O4C20H20 |
AB2C2D4E20F20 |
-113.17 |
14.24 |
-8.76 |
-1.02 |
0 |
|
|
67249 |
46506138 |
1 |
BrSN3O4C23H36 |
ABC3D4E23F36 |
-175.9 |
7.33 |
-8.62 |
-0.8 |
0 |
|
|
67250 |
46506140 |
1 |
SBr2N2O4C21H22 |
AB2C2D4E21F22 |
-138.07 |
9.54 |
-8.79 |
-0.94 |
0 |