List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
179034 |
76424357 |
1 |
ClN2O4C16H17 |
AB2C4D16E17 |
-138.5 |
3.4 |
-9.89 |
-1.5 |
0 |
|
|
179035 |
76424358 |
1 |
O2N7C16H19 |
A2B7C16D19 |
24.9 |
8.61 |
-10.17 |
-0.42 |
0 |
|
|
179036 |
76424359 |
1 |
ClO2N3C16H24 |
AB2C3D16E24 |
-52.24 |
3.85 |
-8.77 |
-0.71 |
0 |
|
|
179037 |
76424538 |
1 |
ON6C15H22 |
AB6C15D22 |
15.95 |
4.8 |
-8.85 |
-0.28 |
0 |
|
|
179038 |
76424877 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-71.73 |
6.7 |
-9.48 |
0.2 |
0 |
|
|
179039 |
76425147 |
1 |
O2N3C21H29 |
A2B3C21D29 |
-67.46 |
4.69 |
-9.24 |
0.14 |
0 |
|
|
179040 |
76425557 |
1 |
O2N4C19H30 |
A2B4C19D30 |
-77.78 |
3.77 |
-8.51 |
0.87 |
0 |
|
|
179041 |
76425583 |
1 |
OSN3C12H17 |
ABC3D12E17 |
17.92 |
4.1 |
-9.26 |
-0.16 |
0 |
|
|
179042 |
76425819 |
1 |
ON4C21H30 |
AB4C21D30 |
-35.05 |
3.12 |
-8.09 |
0.25 |
0 |
|
|
179043 |
76426192 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-78.6 |
4.96 |
-9.6 |
-1.75 |
0 |
|
|
179044 |
76426411 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-35.38 |
2.86 |
-8.62 |
-0.3 |
0 |
|
|
179045 |
76426684 |
1 |
NO3C19H23 |
AB3C19D23 |
-100.42 |
8.06 |
-8.93 |
-0.87 |
0 |
|
|
179046 |
76426901 |
1 |
O2N7C15H19 |
A2B7C15D19 |
57.39 |
4.11 |
-9.39 |
-1.13 |
0 |
|
|
179047 |
76426951 |
2 |
NOC9H12 |
ABC9D12 |
-45.63 |
2.28 |
-8.92 |
0.46 |
0 |
|
|
179048 |
76426976 |
1 |
SN2O2C20H30 |
AB2C2D20E30 |
-63.44 |
5.66 |
-8.94 |
-0.02 |
0 |
|
|
179049 |
76427082 |
1 |
OSN3C15H23 |
ABC3D15E23 |
68.78 |
2.63 |
-8.75 |
-0.34 |
0 |
|
|
179050 |
76427083 |
1 |
ClON3H14C15 |
ABC3D14E15 |
18.5 |
3.09 |
-8.57 |
-0.38 |
0 |
|
|
179051 |
76427339 |
1 |
NO6C20H23 |
AB6C20D23 |
-232.86 |
6.15 |
-9.84 |
-0.41 |
0 |
|
|
179052 |
76427685 |
1 |
O4H18C21 |
A4B18C21 |
-82.33 |
4.94 |
-9.32 |
-1.31 |
0 |
|
|
179053 |
76427818 |
1 |
ClSO3N7C16H18 |
ABC3D7E16F18 |
67.87 |
7.55 |
-9.94 |
-1.3 |
0 |
|
|
179054 |
76427819 |
1 |
ClSO3N7C19H24 |
ABC3D7E19F24 |
43.96 |
5.21 |
-9.04 |
-1.09 |
0 |
|
|
179055 |
76427838 |
1 |
SN2F3O10C46H85 |
AB2C3D10E46F85 |
-759.25 |
3.27 |
-8.6 |
-0.85 |
0 |
|
|
179056 |
76427839 |
1 |
SN2O8C44H84 |
AB2C8D44E84 |
-516.54 |
4.67 |
-8.53 |
-0.12 |
0 |
|
|
179057 |
76427852 |
1 |
ClNO4C30H38 |
ABC4D30E38 |
-141.24 |
4.22 |
-9.44 |
-0.6 |
0 |
|
|
179058 |
76427935 |
1 |
SN5O9C26H47 |
AB5C9D26E47 |
-448.83 |
3.63 |
-9.25 |
-0.02 |
0 |
|
|
179059 |
76427936 |
1 |
O25N30C136H230 |
A25B30C136D230 |
-1272.25 |
10.78 |
-8.97 |
-0.69 |
0 |
|
|
179060 |
76427937 |
3 |
N5O8C29H45 |
A5B8C29D45 |
-1105.84 |
5.61 |
-9.17 |
-0.74 |
0 |
|
|
179061 |
76427938 |
1 |
FSN2O7H23C25 |
ABC2D7E23F25 |
-240.74 |
2.5 |
-8.74 |
-1.53 |
0 |
|
|
179062 |
76428840 |
1 |
O3N4H24C27 |
A3B4C24D27 |
-37.85 |
3.11 |
-8.71 |
-0.86 |
0 |
|
|
179063 |
76429427 |
1 |
O4N5C21H25 |
A4B5C21D25 |
-117.79 |
2.23 |
-9.54 |
-0.58 |
0 |
|
|
179064 |
76429428 |
2 |
ON2C12H13 |
AB2C12D13 |
-23.74 |
2.49 |
-8.56 |
-0.09 |
0 |
|
|
179065 |
76429429 |
1 |
ClO2N3C21H22 |
AB2C3D21E22 |
-47.26 |
0.9 |
-9.33 |
-0.2 |
0 |
|
|
179066 |
76429430 |
1 |
F2N3O3C16H17 |
A2B3C3D16E17 |
-194.55 |
3.88 |
-9.7 |
-0.94 |
0 |
|
|
179067 |
76429431 |
1 |
O2N3C35H37 |
A2B3C35D37 |
-23.56 |
2.83 |
-8.43 |
-0.54 |
0 |
|
|
179068 |
76429433 |
1 |
Cl2N3O4C15H15 |
A2B3C4D15E15 |
-159.04 |
3.6 |
-9.86 |
-1.04 |
0 |
|
|
179069 |
76429531 |
1 |
F2O2N3C21H21 |
A2B2C3D21E21 |
-125.36 |
3.81 |
-9.3 |
-0.41 |
0 |
|
|
179070 |
76429532 |
1 |
O3N4C21H24 |
A3B4C21D24 |
-78.73 |
2.78 |
-8.98 |
-0.13 |
0 |
|
|
179071 |
76429533 |
1 |
ClO2N5C21H26 |
AB2C5D21E26 |
-37.13 |
2.27 |
-9.29 |
-0.91 |
0 |
|
|
179072 |
76429534 |
1 |
F3N4O4C23H23 |
A3B4C4D23E23 |
-281.79 |
3.57 |
-9.02 |
-0.71 |
0 |
|
|
179073 |
76429708 |
1 |
N2O2C31H36 |
A2B2C31D36 |
-37.08 |
4.85 |
-8.31 |
-0.26 |
0 |
|
|
179074 |
76429881 |
1 |
N3O4C16H19 |
A3B4C16D19 |
-146.07 |
5.76 |
-9.36 |
-0.3 |
0 |
|
|
179075 |
76429882 |
1 |
Cl2O3N4C18H22 |
A2B3C4D18E22 |
-121.28 |
5.0 |
-9.53 |
-1.05 |
0 |
|
|
179076 |
76430063 |
1 |
ClN4O4C16H19 |
AB4C4D16E19 |
-163.82 |
4.34 |
-8.87 |
-0.25 |
0 |
|
|
179077 |
76430454 |
1 |
O2F3N3C27H32 |
A2B3C3D27E32 |
-207.45 |
7.19 |
-8.68 |
-0.59 |
0 |
|
|
179078 |
76430707 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-6.84 |
4.24 |
-8.82 |
0.25 |
0 |
|
|
179079 |
76430708 |
3 |
NOC7H9 |
ABC7D9 |
-117.63 |
5.2 |
-9.56 |
-0.44 |
0 |
|
|
179080 |
76430747 |
1 |
N3O4H23C25 |
A3B4C23D25 |
-95.6 |
3.16 |
-8.76 |
-0.5 |
0 |
|
|
179081 |
76430748 |
1 |
FO2N3C30H32 |
AB2C3D30E32 |
-81.69 |
0.16 |
-8.43 |
-0.27 |
0 |
|
|
179082 |
76430749 |
1 |
ClSO2N4C21H21 |
ABC2D4E21F21 |
-14.73 |
2.97 |
-8.73 |
-0.5 |
0 |
|
|
179083 |
76431208 |
1 |
FON3C29H34 |
ABC3D29E34 |
-40.49 |
4.18 |
-8.84 |
-0.42 |
0 |