List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
306044 |
125000879 |
1 |
FN3O3C16H18 |
AB3C3D16E18 |
-117.39 |
2.91 |
-9.12 |
0.09 |
0 |
|
|
306045 |
125000896 |
1 |
O2N5C16H21 |
A2B5C16D21 |
-5.92 |
3.98 |
-9.4 |
-1.06 |
0 |
|
|
306046 |
125000901 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
-19.08 |
5.75 |
-8.71 |
-0.64 |
0 |
|
|
306047 |
125000904 |
1 |
SO4N5C16H19 |
AB4C5D16E19 |
-80.64 |
7.03 |
-9.74 |
-1.43 |
0 |
|
|
306048 |
125000914 |
1 |
N3O5C17H17 |
A3B5C17D17 |
-126.48 |
9.5 |
-9.39 |
-0.84 |
0 |
|
|
306049 |
125000934 |
1 |
O3N4C14H24 |
A3B4C14D24 |
-89.86 |
5.07 |
-9.02 |
-0.27 |
0 |
|
|
306050 |
125001039 |
1 |
SN7C17H21 |
AB7C17D21 |
93.33 |
5.34 |
-8.32 |
-0.83 |
0 |
|
|
306051 |
125001046 |
1 |
Cl2N3O3C21H23 |
A2B3C3D21E23 |
-103.78 |
5.89 |
-9.27 |
-1.07 |
0 |
|
|
306052 |
125001062 |
1 |
NO3C18H27 |
AB3C18D27 |
-112.65 |
4.56 |
-8.67 |
0.33 |
0 |
|
|
306053 |
125001071 |
1 |
O3N5C14H17 |
A3B5C14D17 |
-45.01 |
6.07 |
-8.67 |
-0.36 |
0 |
|
|
306054 |
125001455 |
2 |
ON3C12H16 |
AB3C12D16 |
-19.65 |
2.99 |
-9.1 |
-0.98 |
0 |
|
|
306055 |
125001458 |
2 |
FON2C8H11 |
ABC2D8E11 |
-177.74 |
3.88 |
-8.87 |
-0.44 |
0 |
|
|
306056 |
125001468 |
1 |
FO2N4C22H23 |
AB2C4D22E23 |
-30.37 |
5.15 |
-9.47 |
-0.8 |
0 |
|
|
306057 |
125001488 |
1 |
OSN3C16H19 |
ABC3D16E19 |
-2.09 |
4.27 |
-8.73 |
-0.69 |
0 |
|
|
306058 |
125001491 |
1 |
O2N4C15H16 |
A2B4C15D16 |
-30.71 |
7.09 |
-9.64 |
-0.89 |
0 |
|
|
306059 |
125001494 |
1 |
F2N2O3C18H24 |
A2B2C3D18E24 |
-227.39 |
2.98 |
-9.15 |
-0.06 |
0 |
|
|
306060 |
125001495 |
1 |
OF3N3H22C23 |
AB3C3D22E23 |
-119.04 |
2.59 |
-8.94 |
-0.55 |
0 |
|
|
306061 |
125001497 |
2 |
NOC9H10 |
ABC9D10 |
-37.17 |
2.32 |
-9.43 |
-0.02 |
0 |
|
|
306062 |
125001506 |
1 |
ON2C27H32 |
AB2C27D32 |
5.48 |
3.97 |
-8.82 |
-0.5 |
0 |
|
|
306063 |
125001508 |
1 |
NO3C17H25 |
AB3C17D25 |
-125.99 |
1.88 |
-8.61 |
0.34 |
0 |
|
|
306064 |
125001509 |
1 |
NO2C17H25 |
AB2C17D25 |
-93.1 |
1.11 |
-8.93 |
0.52 |
0 |
|
|
306065 |
125001513 |
1 |
FN3O3C25H30 |
AB3C3D25E30 |
-142.25 |
4.3 |
-9.43 |
-0.62 |
0 |
|
|
306066 |
125001517 |
1 |
SO2N4C16H18 |
AB2C4D16E18 |
23.23 |
2.02 |
-8.0 |
-0.16 |
0 |
|
|
306067 |
125001527 |
1 |
ClSO2N3C27H32 |
ABC2D3E27F32 |
-23.2 |
4.83 |
-8.88 |
-0.54 |
0 |
|
|
306068 |
125001530 |
1 |
O2N5C14H23 |
A2B5C14D23 |
-46.98 |
3.93 |
-8.96 |
-0.19 |
0 |
|
|
306069 |
125001540 |
1 |
ClN2O3H19C20 |
AB2C3D19E20 |
-63.92 |
5.81 |
-9.39 |
-0.95 |
0 |
|
|
306070 |
125001556 |
1 |
O3N4C24H38 |
A3B4C24D38 |
-130.06 |
5.07 |
-9.28 |
0.01 |
0 |
|
|
306071 |
125001558 |
1 |
S2O3N4C14H18 |
A2B3C4D14E18 |
-32.62 |
5.81 |
-9.15 |
-0.81 |
0 |
|
|
306072 |
125001559 |
1 |
S2O3N4C14H18 |
A2B3C4D14E18 |
-32.68 |
5.9 |
-9.06 |
-0.99 |
0 |
|
|
306073 |
125001561 |
1 |
ON5C16H23 |
AB5C16D23 |
3.07 |
5.01 |
-9.12 |
0.25 |
0 |
|
|
306074 |
125001567 |
1 |
O3N6C25H34 |
A3B6C25D34 |
-64.75 |
9.01 |
-8.02 |
-0.51 |
0 |
|
|
306075 |
125001571 |
1 |
OSN4C17H22 |
ABC4D17E22 |
-6.05 |
4.51 |
-8.42 |
-0.59 |
0 |
|
|
306076 |
125001574 |
1 |
ON4C18H24 |
AB4C18D24 |
-1.5 |
5.47 |
-9.22 |
-0.22 |
0 |
|
|
306077 |
125001577 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-68.39 |
3.0 |
-9.46 |
-0.39 |
0 |
|
|
306079 |
125001583 |
1 |
ON4C19H24 |
AB4C19D24 |
1.72 |
4.12 |
-8.48 |
-0.4 |
0 |
|
|
306080 |
125001584 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-34.83 |
5.96 |
-8.85 |
-0.32 |
0 |
|
|
306081 |
125001586 |
1 |
ON5C21H31 |
AB5C21D31 |
-4.46 |
2.98 |
-9.15 |
-1.05 |
0 |
|
|
306082 |
125001590 |
1 |
FN3O3C25H26 |
AB3C3D25E26 |
-109.31 |
9.77 |
-8.72 |
-0.3 |
0 |
|
|
306083 |
125001592 |
1 |
O2N5C26H31 |
A2B5C26D31 |
-16.18 |
4.68 |
-8.94 |
-0.78 |
0 |
|
|
306084 |
125001596 |
1 |
ON3C17H19 |
AB3C17D19 |
11.91 |
6.3 |
-8.54 |
-0.22 |
0 |
|
|
306085 |
125001608 |
1 |
FON6C27H27 |
ABC6D27E27 |
27.95 |
5.79 |
-9.2 |
-1.04 |
0 |
|
|
306086 |
125001618 |
1 |
OSN4C17H18 |
ABC4D17E18 |
43.43 |
3.2 |
-9.02 |
-0.5 |
0 |
|
|
306087 |
125001621 |
1 |
ON5C20H25 |
AB5C20D25 |
0.78 |
6.29 |
-8.36 |
0.06 |
0 |
|
|
306088 |
125001622 |
1 |
ON5C20H25 |
AB5C20D25 |
1.32 |
4.64 |
-8.21 |
-0.08 |
0 |
|
|
306089 |
125001625 |
1 |
O2N5C25H29 |
A2B5C25D29 |
-3.87 |
5.69 |
-8.72 |
-0.5 |
0 |
|
|
306090 |
125001626 |
1 |
O2N5C25H29 |
A2B5C25D29 |
-5.99 |
4.97 |
-8.51 |
-0.4 |
0 |
|
|
306091 |
125001627 |
1 |
ClSO2N3C22H22 |
ABC2D3E22F22 |
-19.54 |
4.26 |
-9.39 |
-0.92 |
0 |
|
|
306092 |
125001629 |
1 |
O2S2N4C17H24 |
A2B2C4D17E24 |
-38.24 |
4.91 |
-9.42 |
-1.28 |
0 |
|
|
306093 |
125001630 |
1 |
O2S2N4C17H24 |
A2B2C4D17E24 |
-38.56 |
4.37 |
-9.42 |
-1.27 |
0 |
|
|
306094 |
125001633 |
1 |
O3N6C22H26 |
A3B6C22D26 |
-68.93 |
10.16 |
-8.72 |
-0.57 |
0 |