List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
358988 |
127296879 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-45.0 |
1.01 |
-8.81 |
-0.37 |
0 |
|
|
358989 |
127297181 |
1 |
N3O4C18H31 |
A3B4C18D31 |
-193.83 |
4.63 |
-9.08 |
0.55 |
0 |
|
|
358990 |
127297182 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-91.2 |
3.48 |
-9.19 |
-0.2 |
0 |
|
|
358991 |
127297183 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-51.94 |
5.27 |
-9.32 |
-1.4 |
0 |
|
|
358992 |
127297184 |
1 |
N3O3C20H35 |
A3B3C20D35 |
-173.79 |
5.33 |
-9.1 |
0.8 |
0 |
|
|
358993 |
127297185 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-165.6 |
7.46 |
-9.26 |
0.41 |
0 |
|
|
358994 |
127297186 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-135.53 |
3.52 |
-8.74 |
0.05 |
0 |
|
|
358995 |
127297187 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-69.55 |
4.55 |
-9.23 |
-0.71 |
0 |
|
|
358996 |
127297188 |
1 |
O2N7C16H27 |
A2B7C16D27 |
-31.0 |
1.84 |
-9.41 |
-0.8 |
0 |
|
|
358997 |
127297189 |
1 |
SO3N4C18H30 |
AB3C4D18E30 |
-152.83 |
2.52 |
-9.12 |
-0.42 |
0 |
|
|
358998 |
127297190 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-173.78 |
4.27 |
-9.24 |
0.59 |
0 |
|
|
358999 |
127297243 |
1 |
FN3O3C19H26 |
AB3C3D19E26 |
-159.21 |
7.97 |
-8.76 |
-0.71 |
0 |
|
|
359000 |
127297244 |
2 |
ON2C11H16 |
AB2C11D16 |
-59.8 |
5.07 |
-8.6 |
-0.31 |
0 |
|
|
359001 |
127297245 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-119.77 |
7.31 |
-8.34 |
-0.94 |
0 |
|
|
359002 |
127297246 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-164.03 |
1.36 |
-8.75 |
0.63 |
0 |
|
|
359003 |
127297247 |
2 |
ON2C10H16 |
AB2C10D16 |
-72.42 |
5.83 |
-8.48 |
0.11 |
0 |
|
|
359004 |
127297248 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-127.26 |
3.59 |
-8.52 |
-0.78 |
0 |
|
|
359005 |
127297249 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-120.7 |
5.76 |
-8.78 |
-0.96 |
0 |
|
|
359006 |
127297250 |
1 |
N3O3C22H39 |
A3B3C22D39 |
-185.44 |
3.23 |
-8.28 |
0.6 |
0 |
|
|
359007 |
127297251 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-144.22 |
2.71 |
-8.65 |
-0.61 |
0 |
|
|
359008 |
127297252 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-31.27 |
5.25 |
-8.8 |
-1.28 |
0 |
|
|
359009 |
127297253 |
1 |
FSN2O2C19H25 |
ABC2D2E19F25 |
-138.03 |
3.52 |
-9.35 |
-0.26 |
0 |
|
|
359010 |
127297254 |
1 |
SN2O5C19H28 |
AB2C5D19E28 |
-201.57 |
7.55 |
-9.14 |
-0.5 |
0 |
|
|
359011 |
127297255 |
1 |
ClN3O3C15H16 |
AB3C3D15E16 |
-115.74 |
3.44 |
-9.06 |
-0.39 |
0 |
|
|
359012 |
127297256 |
1 |
ClO3N4C19H25 |
AB3C4D19E25 |
-137.65 |
6.18 |
-9.01 |
-0.16 |
0 |
|
|
359013 |
127297257 |
1 |
O3N4C18H30 |
A3B4C18D30 |
-151.14 |
10.99 |
-8.9 |
0.58 |
0 |
|
|
359014 |
127297258 |
2 |
ON3C8H13 |
AB3C8D13 |
-39.57 |
4.8 |
-8.79 |
-0.25 |
0 |
|
|
359015 |
127297259 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-42.72 |
5.3 |
-8.81 |
-0.74 |
0 |
|
|
359016 |
127297260 |
1 |
O4N5C19H29 |
A4B5C19D29 |
-179.26 |
6.89 |
-8.83 |
-0.67 |
0 |
|
|
359017 |
127297261 |
1 |
O3N5C19H29 |
A3B5C19D29 |
-113.65 |
4.02 |
-8.78 |
-0.87 |
0 |
|
|
359018 |
127297262 |
1 |
ON4C14H14 |
AB4C14D14 |
54.49 |
6.38 |
-9.11 |
-1.08 |
0 |
|
|
359019 |
127297263 |
3 |
ON2C5H6 |
AB2C5D6 |
-49.64 |
3.62 |
-9.34 |
-0.82 |
0 |
|
|
359020 |
127297264 |
1 |
SN4O4C18H22 |
AB4C4D18E22 |
-94.54 |
6.72 |
-9.34 |
-1.34 |
0 |
|
|
359021 |
127297265 |
1 |
SN4O4C16H18 |
AB4C4D16E18 |
-85.15 |
5.62 |
-9.87 |
-1.29 |
0 |
|
|
359022 |
127297266 |
1 |
SN2O2C13H14 |
AB2C2D13E14 |
-14.67 |
4.16 |
-9.6 |
-1.05 |
0 |
|
|
359023 |
127297267 |
2 |
ON2C8H12 |
AB2C8D12 |
-58.84 |
5.33 |
-9.53 |
0.67 |
0 |
|
|
359024 |
127297268 |
1 |
N2O3C16H18 |
A2B3C16D18 |
-58.68 |
4.37 |
-8.75 |
0.0 |
0 |
|
|
359025 |
127297269 |
3 |
NOC5H5 |
ABC5D5 |
-51.76 |
3.23 |
-9.08 |
-0.67 |
0 |
|
|
359026 |
127297270 |
1 |
SN3O3C11H17 |
AB3C3D11E17 |
-89.08 |
9.62 |
-10.02 |
-0.16 |
0 |
|
|
359027 |
127297271 |
1 |
SN4O4C16H18 |
AB4C4D16E18 |
-82.11 |
6.67 |
-9.9 |
-1.4 |
0 |
|
|
359028 |
127297272 |
1 |
ON5C16H23 |
AB5C16D23 |
22.31 |
1.94 |
-9.02 |
0.56 |
0 |
|
|
359029 |
127297273 |
1 |
SO2N3C14H21 |
AB2C3D14E21 |
-57.9 |
6.44 |
-9.16 |
-0.34 |
0 |
|
|
359030 |
127297274 |
1 |
SO3N4C16H26 |
AB3C4D16E26 |
-107.67 |
3.37 |
-8.88 |
-0.4 |
0 |
|
|
359031 |
127297275 |
1 |
SN3O4C19H23 |
AB3C4D19E23 |
-115.02 |
4.41 |
-8.78 |
-0.44 |
0 |
|
|
359032 |
127297276 |
1 |
SO3N4C16H24 |
AB3C4D16E24 |
-84.03 |
6.09 |
-8.98 |
-0.62 |
0 |
|
|
359033 |
127297277 |
1 |
SO2N4C21H24 |
AB2C4D21E24 |
-13.87 |
6.33 |
-8.3 |
-0.67 |
0 |
|
|
359034 |
127297278 |
1 |
SO3N4C19H28 |
AB3C4D19E28 |
-96.83 |
1.88 |
-9.15 |
-0.58 |
0 |
|
|
359035 |
127297279 |
1 |
SO2N4C19H30 |
AB2C4D19E30 |
-65.34 |
3.69 |
-8.66 |
-0.7 |
0 |
|
|
359036 |
127297280 |
1 |
SF2O2N5C16H21 |
AB2C2D5E16F21 |
-123.05 |
6.74 |
-9.42 |
-1.19 |
0 |
|
|
359037 |
127297281 |
1 |
SO3N4C19H28 |
AB3C4D19E28 |
-95.13 |
4.88 |
-9.27 |
-0.78 |
0 |