List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
26007 |
635588 |
1 |
N4O6C35H44 |
A4B6C35D44 |
-204.77 |
9.85 |
-8.57 |
-1.61 |
0 |
|
|
26008 |
635741 |
1 |
NO3C14H21 |
AB3C14D21 |
-149.96 |
2.92 |
-8.71 |
-0.21 |
-6 |
|
|
26009 |
635777 |
1 |
FeP2C35H38 |
AB2C35D38 |
209.23 |
2.59 |
-7.01 |
-1.58 |
0 |
|
|
26010 |
635779 |
2 |
SO2C15H16 |
AB2C15D16 |
-104.49 |
3.0 |
-8.59 |
-1.05 |
0 |
|
|
26011 |
635853 |
1 |
Si3O4C28H50 |
A3B4C28D50 |
-349.42 |
1.38 |
-8.28 |
0.27 |
0 |
|
|
26013 |
635880 |
1 |
O9H28C32 |
A9B28C32 |
-346.04 |
6.7 |
-8.57 |
-0.74 |
0 |
|
|
26014 |
635922 |
2 |
N4C37H46 |
A4B37C46 |
244.78 |
1.58 |
-7.2 |
-1.23 |
0 |
|
|
26015 |
635963 |
1 |
ClO2N3C36H44 |
AB2C3D36E44 |
-43.38 |
6.11 |
-8.55 |
-0.71 |
0 |
|
|
26016 |
635964 |
1 |
NO6H10C21F21 |
AB6C10D21E21 |
-1255.21 |
5.58 |
-9.83 |
-1.31 |
0 |
|
|
26017 |
636043 |
2 |
OPH14C19 |
ABC14D19 |
28.2 |
3.4 |
-8.4 |
-1.03 |
0 |
|
|
26018 |
636314 |
1 |
O2C53H106 |
A2B53C106 |
-333.8 |
1.89 |
-10.41 |
0.88 |
0 |
|
|
26019 |
636385 |
1 |
N3O7C23H31 |
A3B7C23D31 |
-290.09 |
9.05 |
-9.71 |
-0.42 |
0 |
|
|
26020 |
636386 |
1 |
ON3C19H25 |
AB3C19D25 |
-15.8 |
4.63 |
-9.41 |
0.03 |
0 |
|
|
26021 |
636388 |
1 |
O3C20H26 |
A3B20C26 |
-141.87 |
7.04 |
-9.73 |
-0.11 |
0 |
|
|
26022 |
636396 |
1 |
SN5O14C18H39 |
AB5C14D18E39 |
-625.61 |
2.25 |
-9.39 |
-1.41 |
0 |
|
|
26023 |
636397 |
1 |
NO12C32H37 |
AB12C32D37 |
-479.72 |
9.64 |
-9.06 |
-2.01 |
0 |
|
|
26024 |
636398 |
1 |
O7C28H40 |
A7B28C40 |
-336.31 |
4.53 |
-9.89 |
-0.45 |
0 |
|
|
26025 |
636399 |
1 |
ClN2O2C11H17 |
AB2C2D11E17 |
-76.48 |
1.78 |
-8.8 |
-0.14 |
0 |
|
|
26026 |
636403 |
1 |
O7C34H50 |
A7B34C50 |
-383.24 |
6.54 |
-9.55 |
0.1 |
0 |
|
|
26027 |
636416 |
1 |
O5N7C17H23 |
A5B7C17D23 |
-194.49 |
1.58 |
-9.66 |
-0.46 |
0 |
|
|
26028 |
636465 |
2 |
NC6H6 |
AB6C6 |
85.65 |
1.54 |
-8.58 |
-0.24 |
0 |
|
|
26029 |
636496 |
2 |
O3H10C11 |
A3B10C11 |
-178.15 |
5.34 |
-8.44 |
-0.67 |
0 |
|
|
26030 |
636497 |
1 |
ClO3H13C15 |
AB3C13D15 |
-90.13 |
1.65 |
-8.39 |
-0.41 |
0 |
|
|
26031 |
636498 |
1 |
O7C15H20 |
A7B15C20 |
-274.14 |
4.56 |
-10.47 |
-0.51 |
0 |
|
|
26032 |
636500 |
1 |
O7C23H30 |
A7B23C30 |
-262.12 |
5.34 |
-9.07 |
-0.95 |
0 |
|
|
26033 |
636618 |
1 |
O2C15H26 |
A2B15C26 |
-127.13 |
1.8 |
-10.02 |
0.96 |
0 |
|
|
26034 |
636640 |
1 |
NO17C36H45 |
AB17C36D45 |
-743.83 |
8.28 |
-10.21 |
-0.88 |
0 |
|
|
26035 |
636672 |
1 |
NSO5C27H39 |
ABC5D27E39 |
-207.04 |
2.14 |
-8.75 |
-0.35 |
0 |
|
|
26036 |
636673 |
1 |
O4C27H32 |
A4B27C32 |
-137.04 |
4.64 |
-8.66 |
-0.66 |
0 |
|
|
26037 |
636674 |
2 |
O2C15H24 |
A2B15C24 |
-238.4 |
3.82 |
-9.06 |
0.9 |
0 |
|
|
26038 |
636784 |
1 |
O10C31H52 |
A10B31C52 |
-488.78 |
4.37 |
-9.12 |
0.62 |
0 |
|
|
26039 |
636789 |
1 |
ON3C36H37 |
AB3C36D37 |
121.59 |
1.54 |
-7.5 |
-1.54 |
0 |
|
|
26040 |
636804 |
1 |
N2O3C32H54 |
A2B3C32D54 |
-143.98 |
3.19 |
-8.42 |
0.81 |
0 |
|
|
26041 |
636808 |
1 |
O3C20H24 |
A3B20C24 |
-62.87 |
6.67 |
-9.39 |
-0.44 |
0 |
|
|
26042 |
636809 |
1 |
O2C15H20 |
A2B15C20 |
-57.41 |
2.19 |
-9.93 |
-0.33 |
0 |
|
|
26043 |
636861 |
2 |
O3C12H13 |
A3B12C13 |
-215.58 |
3.07 |
-8.79 |
-0.89 |
0 |
|
|
26044 |
636883 |
1 |
O5H16C20 |
A5B16C20 |
-140.09 |
2.22 |
-8.87 |
-0.85 |
0 |
|
|
26045 |
636884 |
4 |
OH3C4 |
AB3C4 |
-111.49 |
2.24 |
-8.4 |
-1.03 |
2 |
|
|
26046 |
636885 |
2 |
ON2C20H20 |
AB2C20D20 |
142.48 |
22.06 |
-4.59 |
-2.19 |
0 |
|
|
26047 |
636886 |
6 |
O2C5H7 |
A2B5C7 |
-540.9 |
7.08 |
-9.96 |
0.14 |
0 |
|
|
26048 |
636887 |
1 |
BrO3C17H25 |
AB3C17D25 |
-135.7 |
4.32 |
-8.47 |
-0.24 |
0 |
|
|
26049 |
637009 |
1 |
O11C37H54 |
A11B37C54 |
-484.98 |
3.28 |
-10.14 |
0.14 |
0 |
|
|
26050 |
637117 |
1 |
O5H12C16 |
A5B12C16 |
-148.54 |
4.65 |
-9.67 |
-1.06 |
0 |
|
|
26051 |
637118 |
1 |
O15C33H34 |
A15B33C34 |
-594.95 |
11.11 |
-9.35 |
-1.34 |
0 |
|
|
26052 |
637164 |
1 |
O3H14C16 |
A3B14C16 |
-61.36 |
1.61 |
-8.45 |
-0.08 |
0 |
|
|
26053 |
637169 |
1 |
O5H22C27 |
A5B22C27 |
-95.87 |
3.8 |
-9.3 |
-1.3 |
0 |
|
|
26054 |
637232 |
1 |
NO4C26H31 |
AB4C26D31 |
-134.15 |
2.38 |
-8.62 |
-1.37 |
0 |
|
|
26055 |
637268 |
3 |
OC10H16 |
AB10C16 |
-209.54 |
4.59 |
-9.49 |
0.94 |
0 |
|
|
26056 |
637277 |
1 |
OCl2H6C8 |
AB2C6D8 |
-32.44 |
3.13 |
-10.11 |
-0.81 |
0 |
|
|
26057 |
637392 |
2 |
O4C13H17 |
A4B13C17 |
-310.11 |
3.69 |
-9.07 |
-0.69 |
0 |