List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
416013 |
135089018 |
1 |
N3O3C21H23 |
A3B3C21D23 |
1.97 |
5.61 |
-8.45 |
-0.64 |
0 |
|
|
416014 |
135089019 |
1 |
O3N5C18H19 |
A3B5C18D19 |
-10.97 |
8.41 |
-9.89 |
-1.14 |
0 |
|
|
416015 |
135089020 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-82.02 |
8.38 |
-9.22 |
-0.14 |
0 |
|
|
416016 |
135089021 |
2 |
FNO2C9H10 |
ABC2D9E10 |
-198.36 |
4.53 |
-9.68 |
-0.6 |
0 |
|
|
416017 |
135089022 |
1 |
NO5C22H25 |
AB5C22D25 |
-180.38 |
1.98 |
-8.85 |
-0.04 |
0 |
|
|
416018 |
135089023 |
2 |
ON3C12H14 |
AB3C12D14 |
0.96 |
2.39 |
-8.84 |
-0.67 |
0 |
|
|
416019 |
135089024 |
1 |
N6O9C36H50 |
A6B9C36D50 |
-357.52 |
7.3 |
-8.5 |
-0.22 |
0 |
|
|
416020 |
135089025 |
1 |
F2O2N4C17H22 |
A2B2C4D17E22 |
-121.93 |
2.39 |
-8.72 |
-0.53 |
0 |
|
|
416021 |
135089026 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-76.42 |
3.72 |
-9.68 |
-0.3 |
0 |
|
|
416022 |
135089027 |
2 |
ON3C8H11 |
AB3C8D11 |
-32.09 |
7.21 |
-9.09 |
-0.44 |
0 |
|
|
416023 |
135089028 |
1 |
N6O6C33H46 |
A6B6C33D46 |
-221.99 |
8.36 |
-8.99 |
-0.76 |
0 |
|
|
416024 |
135089029 |
1 |
O2N5C17H17 |
A2B5C17D17 |
0.1 |
11.5 |
-9.22 |
-1.0 |
0 |
|
|
416025 |
135089030 |
1 |
N3O4C14H17 |
A3B4C14D17 |
-121.27 |
6.22 |
-10.0 |
-0.74 |
0 |
|
|
416026 |
135089031 |
1 |
ON5C16H23 |
AB5C16D23 |
-4.7 |
4.15 |
-8.72 |
-0.03 |
0 |
|
|
416027 |
135089032 |
1 |
OF2N2C19H28 |
AB2C2D19E28 |
-127.4 |
0.59 |
-8.57 |
-0.09 |
0 |
|
|
416028 |
135089033 |
1 |
SN3O5C18H23 |
AB3C5D18E23 |
-132.08 |
5.48 |
-9.56 |
-0.46 |
0 |
|
|
416029 |
135089034 |
3 |
NOC6H9 |
ABC6D9 |
-102.7 |
4.89 |
-8.78 |
-0.48 |
0 |
|
|
416030 |
135089035 |
2 |
N2O2C11H14 |
A2B2C11D14 |
-95.87 |
5.59 |
-9.23 |
-1.15 |
0 |
|
|
416031 |
135089036 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-52.54 |
8.01 |
-9.2 |
0.3 |
0 |
|
|
416033 |
135089038 |
1 |
O3N6C13H14 |
A3B6C13D14 |
73.7 |
6.99 |
-9.94 |
-1.57 |
0 |
|
|
416034 |
135089039 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-55.83 |
5.82 |
-8.37 |
-0.28 |
0 |
|
|
416035 |
135089040 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-131.04 |
7.64 |
-8.69 |
-0.82 |
0 |
|
|
416037 |
135089042 |
1 |
ClO4N5C37H46 |
AB4C5D37E46 |
-157.36 |
8.06 |
-8.4 |
-0.24 |
0 |
|
|
416038 |
135089043 |
3 |
N2C7H10 |
A2B7C10 |
42.44 |
2.82 |
-8.27 |
-0.04 |
0 |
|
|
416039 |
135089044 |
1 |
OSN5C17H25 |
ABC5D17E25 |
0.7 |
3.36 |
-8.82 |
-0.41 |
0 |
|
|
416040 |
135089045 |
1 |
FOCl2N2H19C21 |
ABC2D2E19F21 |
-38.22 |
2.07 |
-9.07 |
-0.78 |
0 |
|
|
416041 |
135089046 |
1 |
O2N4C15H16 |
A2B4C15D16 |
25.11 |
1.87 |
-9.2 |
-0.96 |
0 |
|
|
416042 |
135089047 |
1 |
NO3C21H27 |
AB3C21D27 |
-119.93 |
3.61 |
-8.71 |
-0.45 |
0 |
|
|
416043 |
135089048 |
1 |
O2N5C21H23 |
A2B5C21D23 |
-9.08 |
4.93 |
-8.47 |
-0.54 |
0 |
|
|
416044 |
135089049 |
1 |
O2N3C25H27 |
A2B3C25D27 |
-33.59 |
2.85 |
-8.46 |
-0.1 |
0 |
|
|
416045 |
135089050 |
1 |
S2N3O4C16H21 |
A2B3C4D16E21 |
-128.1 |
5.55 |
-9.44 |
-1.18 |
0 |
|
|
416046 |
135089051 |
1 |
SN2O5C16H24 |
AB2C5D16E24 |
-197.72 |
7.54 |
-9.44 |
-0.44 |
0 |
|
|
416047 |
135089052 |
1 |
ON5C20H27 |
AB5C20D27 |
-7.56 |
5.33 |
-8.42 |
-0.39 |
0 |
|
|
416049 |
135089054 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-59.12 |
5.57 |
-9.14 |
-0.24 |
0 |
|
|
416050 |
135089055 |
2 |
NO2C10H13 |
AB2C10D13 |
-112.85 |
4.89 |
-8.66 |
0.2 |
0 |
|
|
416051 |
135089056 |
1 |
ClO3N4C21H27 |
AB3C4D21E27 |
-52.18 |
6.5 |
-8.75 |
-0.96 |
0 |
|
|
416052 |
135089057 |
1 |
ClN3O5C18H22 |
AB3C5D18E22 |
-144.77 |
2.32 |
-9.29 |
-1.25 |
0 |
|
|
416053 |
135089058 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-31.13 |
6.48 |
-8.59 |
-0.8 |
0 |
|
|
416054 |
135089059 |
1 |
O5N7C29H37 |
A5B7C29D37 |
-110.85 |
7.07 |
-9.45 |
-1.38 |
0 |
|
|
416055 |
135089060 |
1 |
SN2O2H18C19 |
AB2C2D18E19 |
-5.72 |
6.76 |
-9.19 |
-0.86 |
0 |
|
|
416056 |
135089061 |
1 |
ClO4N8C33H39 |
AB4C8D33E39 |
-61.06 |
4.59 |
-9.41 |
-0.8 |
0 |
|
|
416057 |
135089062 |
1 |
NSO5C16H23 |
ABC5D16E23 |
-220.5 |
5.03 |
-9.93 |
-0.84 |
0 |
|
|
416058 |
135089063 |
1 |
O5N6C28H44 |
A5B6C28D44 |
-231.99 |
8.86 |
-9.07 |
-0.05 |
0 |
|
|
416060 |
135089065 |
1 |
SN2F3O5C18H21 |
AB2C3D5E18F21 |
-281.5 |
4.39 |
-9.72 |
-1.35 |
0 |
|
|
416061 |
135089066 |
1 |
ClO2N3C16H20 |
AB2C3D16E20 |
-63.79 |
2.41 |
-9.12 |
-0.05 |
0 |
|
|
416062 |
135089067 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-54.69 |
3.31 |
-9.54 |
-1.2 |
0 |
|
|
416063 |
135089068 |
1 |
ON5C20H23 |
AB5C20D23 |
16.66 |
1.76 |
-8.46 |
-0.1 |
0 |
|
|
416064 |
135089069 |
1 |
ClON3C12H18 |
ABC3D12E18 |
-24.34 |
3.53 |
-8.92 |
-0.41 |
0 |
|
|
416065 |
135089070 |
2 |
N3C10H14 |
A3B10C14 |
43.9 |
2.38 |
-8.63 |
-0.11 |
0 |
|
|
416066 |
135089074 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-41.11 |
4.12 |
-9.14 |
-0.47 |
0 |