List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
186302 |
77416436 |
1 |
O5C23H38 |
A5B23C38 |
-242.71 |
6.48 |
-9.57 |
0.71 |
0 |
|
|
186303 |
77416437 |
1 |
SO6C23H40 |
AB6C23D40 |
-304.84 |
8.07 |
-9.23 |
0.11 |
0 |
|
|
186304 |
77416438 |
2 |
OC9H15 |
AB9C15 |
-122.91 |
1.94 |
-8.49 |
1.39 |
0 |
|
|
186305 |
77416439 |
1 |
SN3O5C20H27 |
AB3C5D20E27 |
-169.49 |
4.02 |
-8.91 |
-0.52 |
0 |
|
|
186306 |
77416882 |
1 |
N4O6C11H12 |
A4B6C11D12 |
-169.95 |
6.53 |
-10.46 |
-1.92 |
0 |
|
|
186307 |
77417894 |
1 |
F3O3H25C26 |
A3B3C25D26 |
-253.37 |
3.04 |
-9.04 |
-0.61 |
0 |
|
|
186308 |
77418308 |
1 |
O2N6C19H20 |
A2B6C19D20 |
18.68 |
6.53 |
-8.42 |
-0.59 |
0 |
|
|
186309 |
77418996 |
1 |
ClN4O5C24H29 |
AB4C5D24E29 |
-131.41 |
5.31 |
-8.69 |
-1.53 |
0 |
|
|
186310 |
77419087 |
1 |
Cl2N3O3C14H27 |
A2B3C3D14E27 |
-190.69 |
8.19 |
-9.16 |
0.1 |
0 |
|
|
186311 |
77419088 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-115.13 |
6.19 |
-8.84 |
0.86 |
0 |
|
|
186312 |
77419184 |
1 |
S2N5O5C31H39 |
A2B5C5D31E39 |
-157.64 |
5.59 |
-8.79 |
-1.01 |
0 |
|
|
186313 |
77419478 |
1 |
F2O2N3H19C22 |
A2B2C3D19E22 |
-51.11 |
3.86 |
-8.86 |
-1.09 |
0 |
|
|
186314 |
77419481 |
2 |
FNOH5C7 |
ABCD5E7 |
-75.69 |
6.6 |
-9.7 |
-1.34 |
0 |
|
|
186315 |
77419716 |
1 |
N2O4C21H32 |
A2B4C21D32 |
-175.11 |
6.19 |
-9.48 |
0.32 |
0 |
|
|
186316 |
77420237 |
1 |
NO9C18H27 |
AB9C18D27 |
-389.62 |
6.87 |
-10.09 |
-0.79 |
0 |
|
|
186317 |
77420286 |
2 |
O3N4C20H23 |
A3B4C20D23 |
-190.62 |
2.71 |
-8.48 |
-0.49 |
0 |
|
|
186318 |
77420287 |
1 |
BrO2N3C17H20 |
AB2C3D17E20 |
-42.39 |
6.96 |
-8.6 |
-0.09 |
0 |
|
|
186319 |
77420288 |
1 |
N5H21C23 |
A5B21C23 |
131.86 |
0.69 |
-8.84 |
-0.78 |
0 |
|
|
186320 |
77420552 |
1 |
BrN2O3C22H25 |
AB2C3D22E25 |
-109.09 |
8.54 |
-8.88 |
-0.46 |
0 |
|
|
186321 |
77420553 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-110.45 |
6.76 |
-9.11 |
-0.38 |
0 |
|
|
186322 |
77421222 |
1 |
FN2O3C25H29 |
AB2C3D25E29 |
-146.9 |
5.98 |
-8.58 |
-0.15 |
0 |
|
|
186323 |
77421223 |
1 |
FNO4C23H24 |
ABC4D23E24 |
-195.88 |
1.93 |
-9.2 |
-0.38 |
0 |
|
|
186324 |
77421224 |
1 |
FNO4C23H26 |
ABC4D23E26 |
-210.45 |
1.81 |
-9.22 |
-0.34 |
0 |
|
|
186325 |
77421225 |
1 |
O7C27H30 |
A7B27C30 |
-290.63 |
3.01 |
-9.18 |
-0.55 |
0 |
|
|
186326 |
77421226 |
1 |
O6C27H32 |
A6B27C32 |
-265.09 |
5.42 |
-9.11 |
-0.13 |
0 |
|
|
186327 |
77421227 |
1 |
NO2C19H21 |
AB2C19D21 |
-61.71 |
3.34 |
-9.15 |
-0.19 |
0 |
|
|
186328 |
77421228 |
2 |
O3C14H17 |
A3B14C17 |
-267.81 |
2.58 |
-9.02 |
-0.04 |
0 |
|
|
186329 |
77421229 |
1 |
NO3C24H29 |
AB3C24D29 |
-115.99 |
5.1 |
-9.26 |
-0.08 |
0 |
|
|
186330 |
77421230 |
1 |
BNO5C23H28 |
ABC5D23E28 |
-252.43 |
1.69 |
-9.18 |
-0.27 |
0 |
|
|
186331 |
77421231 |
1 |
BNO4C25H29 |
ABC4D25E29 |
-116.41 |
4.19 |
0.0 |
0.0 |
0 |
|
|
186332 |
77421644 |
1 |
BrSCl2N2O4C19H19 |
ABC2D2E4F19G19 |
-129.95 |
2.42 |
-9.1 |
-0.78 |
0 |
|
|
186333 |
77421708 |
1 |
ON4C18H20 |
AB4C18D20 |
48.37 |
5.45 |
-8.5 |
-0.69 |
0 |
|
|
186334 |
77421709 |
1 |
N3O3H19C26 |
A3B3C19D26 |
0.7 |
5.62 |
-8.74 |
-1.42 |
0 |
|
|
186335 |
77421794 |
1 |
N3O3C11H13 |
A3B3C11D13 |
-68.93 |
1.7 |
-9.36 |
-0.78 |
0 |
|
|
186336 |
77421978 |
1 |
FSO3N4C33H41 |
ABC3D4E33F41 |
-104.21 |
5.17 |
-8.76 |
-1.13 |
0 |
|
|
186337 |
77422142 |
1 |
F3O6N9C45H52 |
A3B6C9D45E52 |
-330.62 |
7.11 |
-8.56 |
-0.9 |
0 |
|
|
186338 |
77422334 |
1 |
FCl2O2N5C29H32 |
AB2C2D5E29F32 |
-94.22 |
4.38 |
-8.62 |
-0.75 |
0 |
|
|
186339 |
77422335 |
1 |
OSCl2N6C34H38 |
ABC2D6E34F38 |
45.99 |
2.11 |
-8.41 |
-0.68 |
0 |
|
|
186340 |
77422336 |
1 |
FCl2O2N5C30H34 |
AB2C2D5E30F34 |
-98.77 |
8.54 |
-8.93 |
-0.63 |
0 |
|
|
186341 |
77422358 |
1 |
Cl2O3N6C32H40 |
A2B3C6D32E40 |
-65.86 |
4.53 |
-8.82 |
-0.41 |
0 |
|
|
186342 |
77422359 |
1 |
ClO2N6C33H37 |
AB2C6D33E37 |
14.67 |
7.85 |
-8.39 |
-0.43 |
0 |
|
|
186343 |
77422499 |
1 |
NO11C28H31 |
AB11C28D31 |
-425.05 |
3.66 |
-9.31 |
-2.13 |
0 |
|
|
186344 |
77423049 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-6.77 |
1.94 |
-9.46 |
-0.96 |
0 |
|
|
186345 |
77423405 |
1 |
O3N5C12H15 |
A3B5C12D15 |
-83.58 |
3.09 |
-8.94 |
-0.37 |
0 |
|
|
186346 |
77423406 |
1 |
PO9C20H25 |
AB9C20D25 |
-418.11 |
7.53 |
-9.45 |
-0.96 |
0 |
|
|
186347 |
77423711 |
1 |
NSO5C34H35 |
ABC5D34E35 |
-110.56 |
5.81 |
-8.88 |
-0.57 |
0 |
|
|
186348 |
77423807 |
1 |
SN5O7C40H63 |
AB5C7D40E63 |
-302.81 |
5.94 |
-9.4 |
-0.38 |
0 |
|
|
186349 |
77423808 |
1 |
SN5O6C33H53 |
AB5C6D33E53 |
-254.8 |
3.8 |
-8.43 |
-0.8 |
0 |
|
|
186350 |
77423809 |
1 |
SN5O7C34H59 |
AB5C7D34E59 |
-374.38 |
7.32 |
-9.35 |
-0.99 |
0 |
|
|
186351 |
77423986 |
1 |
SF3O3N5H24C29 |
AB3C3D5E24F29 |
-141.5 |
4.44 |
-9.3 |
-1.33 |
0 |