List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126011 |
50948353 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-40.41 |
4.99 |
-9.06 |
-0.35 |
0 |
|
|
126012 |
50948415 |
1 |
O2N5C19H21 |
A2B5C19D21 |
28.84 |
5.67 |
-9.42 |
-0.38 |
0 |
|
|
126013 |
50948431 |
1 |
F2O2N3C13H15 |
A2B2C3D13E15 |
-129.92 |
4.19 |
-9.3 |
-0.67 |
0 |
|
|
126014 |
50948477 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-26.29 |
3.98 |
-8.54 |
-0.06 |
0 |
|
|
126015 |
50948494 |
1 |
SN4O4C14H18 |
AB4C4D14E18 |
-92.05 |
6.0 |
-9.34 |
-0.99 |
0 |
|
|
126016 |
50948516 |
1 |
N6C21H28 |
A6B21C28 |
79.39 |
2.63 |
-8.18 |
-0.38 |
0 |
|
|
126017 |
50948558 |
1 |
SO3N5H15C16 |
AB3C5D15E16 |
-43.16 |
4.58 |
-9.49 |
-1.1 |
0 |
|
|
126018 |
50948595 |
1 |
O2N5C17H29 |
A2B5C17D29 |
-49.93 |
3.68 |
-8.7 |
-0.08 |
0 |
|
|
126019 |
50948616 |
1 |
N5C24H27 |
A5B24C27 |
89.18 |
7.24 |
-8.04 |
-0.82 |
0 |
|
|
126020 |
50948675 |
1 |
N3O5C22H23 |
A3B5C22D23 |
-164.6 |
2.31 |
-8.63 |
-0.27 |
0 |
|
|
126021 |
50948704 |
1 |
OSN6C16H20 |
ABC6D16E20 |
42.44 |
3.5 |
-8.86 |
-1.56 |
0 |
|
|
126022 |
50948795 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-150.45 |
4.7 |
-8.98 |
0.31 |
0 |
|
|
126023 |
50948858 |
1 |
ClON4C17H21 |
ABC4D17E21 |
-18.09 |
3.19 |
-8.96 |
-0.75 |
0 |
|
|
126024 |
50948883 |
1 |
ON5C13H19 |
AB5C13D19 |
28.09 |
3.41 |
-9.22 |
-0.44 |
0 |
|
|
126025 |
50948906 |
1 |
FN2O2C18H19 |
AB2C2D18E19 |
-60.56 |
4.87 |
-9.12 |
-0.26 |
0 |
|
|
126026 |
50948923 |
1 |
ON3C20H25 |
AB3C20D25 |
16.79 |
5.98 |
-8.62 |
-0.11 |
0 |
|
|
126027 |
50948924 |
2 |
NO2C10H12 |
AB2C10D12 |
-134.47 |
3.48 |
-9.76 |
-0.14 |
0 |
|
|
126028 |
50949003 |
1 |
ON5C19H33 |
AB5C19D33 |
-29.8 |
5.19 |
-8.14 |
0.26 |
0 |
|
|
126029 |
50949004 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-70.13 |
4.04 |
-9.04 |
0.68 |
0 |
|
|
126030 |
50949005 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
-3.66 |
5.85 |
-8.87 |
-1.07 |
0 |
|
|
126031 |
50949014 |
2 |
NOC9H10 |
ABC9D10 |
-66.39 |
3.2 |
-8.66 |
-0.19 |
0 |
|
|
126032 |
50949049 |
1 |
OSN3C20H23 |
ABC3D20E23 |
30.92 |
5.3 |
-8.64 |
-0.55 |
0 |
|
|
126033 |
50949053 |
1 |
NO5C17H21 |
AB5C17D21 |
-184.64 |
10.31 |
-9.47 |
-0.48 |
0 |
|
|
126034 |
50949077 |
1 |
SO2N4H16C19 |
AB2C4D16E19 |
41.54 |
4.61 |
-8.64 |
-0.99 |
0 |
|
|
126035 |
50949187 |
2 |
NOC10H11 |
ABC10D11 |
-35.67 |
6.35 |
-9.11 |
-0.3 |
0 |
|
|
126036 |
50949188 |
1 |
OSN2C14H26 |
ABC2D14E26 |
-77.28 |
2.31 |
-8.78 |
0.25 |
0 |
|
|
126037 |
50949213 |
1 |
ON2C19H30 |
AB2C19D30 |
-73.44 |
3.87 |
-8.84 |
1.0 |
0 |
|
|
126038 |
50949214 |
1 |
SO2N4C20H24 |
AB2C4D20E24 |
-46.75 |
6.49 |
-8.85 |
-0.55 |
0 |
|
|
126039 |
50949300 |
1 |
N3C18H19 |
A3B18C19 |
83.1 |
3.06 |
-8.49 |
-0.37 |
0 |
|
|
126040 |
50949354 |
1 |
O3N4H20C21 |
A3B4C20D21 |
4.57 |
2.99 |
-8.75 |
-0.54 |
0 |
|
|
126041 |
50949394 |
1 |
N3O5C19H25 |
A3B5C19D25 |
-170.97 |
5.21 |
-8.5 |
-1.11 |
0 |
|
|
126042 |
50949420 |
1 |
OSN3C19H21 |
ABC3D19E21 |
24.3 |
3.83 |
-8.72 |
-0.69 |
0 |
|
|
126043 |
50949421 |
2 |
ON2C11H12 |
AB2C11D12 |
8.79 |
6.78 |
-8.82 |
-0.43 |
0 |
|
|
126044 |
50949456 |
1 |
ON3C18H27 |
AB3C18D27 |
4.28 |
2.08 |
-8.48 |
0.11 |
0 |
|
|
126045 |
50949507 |
1 |
OSN6C14H20 |
ABC6D14E20 |
44.11 |
3.32 |
-9.39 |
-0.55 |
0 |
|
|
126046 |
50949508 |
1 |
SN3O3C16H23 |
AB3C3D16E23 |
-103.75 |
3.72 |
-8.42 |
0.1 |
0 |
|
|
126047 |
50949638 |
1 |
SN3O4C15H23 |
AB3C4D15E23 |
-174.3 |
6.32 |
-8.97 |
-0.17 |
0 |
|
|
126048 |
50949864 |
1 |
SN2O2F3H15C18 |
AB2C2D3E15F18 |
-142.64 |
4.73 |
-8.87 |
-1.05 |
0 |
|
|
126049 |
50949884 |
2 |
N2O2C11H15 |
A2B2C11D15 |
-115.08 |
7.69 |
-9.94 |
-0.63 |
0 |
|
|
126050 |
50949885 |
1 |
N8C13H20 |
A8B13C20 |
92.81 |
2.22 |
-8.79 |
-0.49 |
0 |
|
|
126051 |
50949892 |
1 |
N2O2C21H22 |
A2B2C21D22 |
-28.84 |
3.71 |
-8.62 |
-0.4 |
0 |
|
|
126052 |
50949893 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-35.74 |
4.91 |
-8.7 |
-0.3 |
0 |
|
|
126053 |
50949894 |
1 |
N5C21H21 |
A5B21C21 |
115.41 |
3.93 |
-8.87 |
-0.8 |
0 |
|
|
126054 |
50949895 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-34.69 |
6.83 |
-8.67 |
-0.18 |
0 |
|
|
126055 |
50949896 |
1 |
ON2C19H28 |
AB2C19D28 |
-61.64 |
2.87 |
-8.82 |
0.23 |
0 |
|
|
126056 |
50949897 |
1 |
FN2O2C22H23 |
AB2C2D22E23 |
-67.17 |
3.69 |
-8.61 |
-0.44 |
0 |
|
|
126057 |
50949898 |
1 |
O3N5C18H21 |
A3B5C18D21 |
8.16 |
3.75 |
-9.1 |
-0.84 |
0 |
|
|
126058 |
50950056 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-134.09 |
5.88 |
-8.67 |
-1.15 |
0 |
|
|
126059 |
50950103 |
1 |
SN2O3C17H24 |
AB2C3D17E24 |
-71.95 |
7.59 |
-9.37 |
-0.32 |
0 |
|
|
126060 |
50950161 |
1 |
O2N6H18C19 |
A2B6C18D19 |
51.14 |
3.79 |
-9.22 |
-0.95 |
0 |
|
|
126061 |
50950175 |
1 |
OSN7C14H17 |
ABC7D14E17 |
71.19 |
5.25 |
-9.06 |
-0.51 |
0 |
|
|
126062 |
50950176 |
1 |
N3O4C20H21 |
A3B4C20D21 |
-109.66 |
2.5 |
-8.77 |
-0.4 |
0 |
|
|
126063 |
50950177 |
1 |
O4N5C19H21 |
A4B5C19D21 |
-107.56 |
6.5 |
-9.41 |
-1.22 |
0 |
|
|
126064 |
50950192 |
1 |
N2O2C23H32 |
A2B2C23D32 |
-65.89 |
2.9 |
-8.57 |
-0.62 |
0 |
|
|
126065 |
50950219 |
1 |
ON4C19H24 |
AB4C19D24 |
18.92 |
1.08 |
-8.86 |
-0.27 |
0 |
|
|
126066 |
50950220 |
1 |
NOH15C18 |
ABC15D18 |
24.91 |
5.0 |
-8.97 |
-0.87 |
0 |
|
|
126067 |
50950221 |
1 |
SO3N5C16H17 |
AB3C5D16E17 |
-22.83 |
5.7 |
-9.16 |
-0.88 |
0 |
|
|
126068 |
50950222 |
1 |
N3O5C20H23 |
A3B5C20D23 |
-160.2 |
7.5 |
-8.82 |
-0.66 |
0 |
|
|
126069 |
50950223 |
2 |
N2C8H13 |
A2B8C13 |
5.11 |
3.53 |
-8.6 |
0.26 |
0 |
|
|
126070 |
50950224 |
1 |
O3N5C17H29 |
A3B5C17D29 |
-99.0 |
5.38 |
-8.89 |
0.86 |
0 |
|
|
126071 |
50950393 |
1 |
SN2O3C18H20 |
AB2C3D18E20 |
-69.11 |
4.22 |
-9.14 |
-0.69 |
0 |
|
|
126072 |
50950421 |
1 |
ClNO5C19H22 |
ABC5D19E22 |
-206.8 |
5.02 |
-9.72 |
-0.78 |
0 |
|
|
126073 |
50950521 |
1 |
N2O4C19H28 |
A2B4C19D28 |
-173.14 |
7.83 |
-8.63 |
-0.08 |
0 |
|
|
126074 |
50950522 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-101.11 |
1.55 |
-9.39 |
0.29 |
0 |
|
|
126075 |
50950523 |
1 |
N3O3C16H23 |
A3B3C16D23 |
-113.78 |
4.23 |
-8.91 |
-0.52 |
0 |
|
|
126076 |
50950524 |
1 |
ClO3N4C18H19 |
AB3C4D18E19 |
-80.44 |
7.06 |
-9.31 |
-1.24 |
0 |
|
|
126077 |
50950525 |
1 |
O2N5C16H17 |
A2B5C16D17 |
7.71 |
4.06 |
-9.94 |
-1.15 |
0 |
|
|
126078 |
50950530 |
1 |
ON4C17H30 |
AB4C17D30 |
-45.35 |
2.72 |
-9.09 |
0.91 |
0 |
|
|
126079 |
50950575 |
1 |
O3N5C18H19 |
A3B5C18D19 |
-51.17 |
5.6 |
-9.3 |
-0.57 |
0 |
|
|
126080 |
50950719 |
1 |
SN7C17H19 |
AB7C17D19 |
112.7 |
5.78 |
-8.75 |
-1.49 |
0 |
|
|
126081 |
50950720 |
1 |
ON3H21C23 |
AB3C21D23 |
72.16 |
3.48 |
-8.59 |
-0.53 |
0 |
|
|
126082 |
50950728 |
1 |
ON6C21H28 |
AB6C21D28 |
50.96 |
5.91 |
-8.71 |
-0.27 |
0 |
|
|
126083 |
50950871 |
1 |
ON3C14H25 |
AB3C14D25 |
-26.99 |
4.85 |
-8.66 |
0.66 |
0 |
|
|
126084 |
50950925 |
1 |
O2N4C17H20 |
A2B4C17D20 |
31.42 |
1.8 |
-9.09 |
-0.54 |
0 |
|
|
126085 |
50950930 |
1 |
ON4C23H24 |
AB4C23D24 |
66.18 |
6.43 |
-8.59 |
0.02 |
0 |