List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
324019 |
126676773 |
1 |
N7C23H25 |
A7B23C25 |
129.53 |
5.38 |
-8.27 |
-0.12 |
0 |
|
|
324020 |
126676774 |
1 |
BrON2C10H13 |
ABC2D10E13 |
-27.89 |
3.73 |
-9.92 |
-0.81 |
0 |
|
|
324021 |
126676775 |
1 |
BrClFPN3O9C20H23 |
ABCDE3F9G20H23 |
-469.52 |
4.21 |
-9.88 |
-1.25 |
0 |
|
|
324022 |
126676777 |
1 |
N8C19H20 |
A8B19C20 |
149.35 |
5.14 |
-9.04 |
-0.88 |
0 |
|
|
324023 |
126676779 |
1 |
NO2C5H11 |
AB2C5D11 |
-64.39 |
1.72 |
-10.19 |
0.6 |
0 |
|
|
324024 |
126676780 |
1 |
FN6H11C18 |
AB6C11D18 |
134.82 |
4.3 |
-9.11 |
-1.5 |
0 |
|
|
324025 |
126676781 |
1 |
ClPN3O9C25H29 |
ABC3D9E25F29 |
-424.93 |
7.54 |
-8.94 |
-0.66 |
0 |
|
|
324026 |
126676782 |
1 |
F3N7H14C17 |
A3B7C14D17 |
-4.22 |
6.07 |
-9.04 |
-0.89 |
0 |
|
|
324027 |
126676783 |
1 |
N7C20H21 |
A7B20C21 |
137.36 |
5.76 |
-8.97 |
-0.82 |
0 |
|
|
324028 |
126676784 |
1 |
F3N7C17H18 |
A3B7C17D18 |
-48.94 |
8.65 |
-8.39 |
-0.53 |
0 |
|
|
324029 |
126676785 |
1 |
N8C17H24 |
A8B17C24 |
110.1 |
5.06 |
-9.0 |
-0.86 |
0 |
|
|
324030 |
126676786 |
1 |
N8H14C17 |
A8B14C17 |
189.32 |
5.63 |
-9.08 |
-0.99 |
0 |
|
|
324031 |
126676787 |
1 |
BrClPN3O9C25H28 |
ABCD3E9F25G28 |
-407.57 |
4.74 |
-9.18 |
-1.29 |
-1 |
|
|
324032 |
126676789 |
1 |
IP2S2O4C5H6 |
AB2C2D4E5F6 |
-184.84 |
5.63 |
0.0 |
0.0 |
0 |
|
|
324033 |
126676790 |
1 |
SN3O3H13C17 |
AB3C3D13E17 |
-24.8 |
6.01 |
-8.15 |
-1.12 |
0 |
|
|
324034 |
126676793 |
1 |
N5C14H21 |
A5B14C21 |
60.38 |
3.94 |
-8.99 |
-0.84 |
0 |
|
|
324035 |
126676795 |
1 |
N6H16C21 |
A6B16C21 |
193.62 |
3.92 |
-8.93 |
-1.46 |
0 |
|
|
324036 |
126676796 |
1 |
F3N3O3C22H28 |
A3B3C3D22E28 |
-260.86 |
5.01 |
-9.38 |
-0.31 |
0 |
|
|
324037 |
126676797 |
1 |
NO3C18H19 |
AB3C18D19 |
-87.04 |
3.46 |
-8.85 |
-0.44 |
0 |
|
|
324038 |
126676801 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-23.65 |
3.09 |
-7.85 |
-1.0 |
0 |
|
|
324039 |
126676803 |
1 |
BrSN2C9H13 |
ABC2D9E13 |
23.19 |
3.38 |
-8.57 |
-0.32 |
0 |
|
|
324040 |
126676807 |
1 |
NC19H23 |
AB19C23 |
25.25 |
2.51 |
-9.04 |
0.35 |
0 |
|
|
324041 |
126676809 |
1 |
NOC13H17 |
ABC13D17 |
-45.77 |
5.62 |
-9.2 |
0.21 |
0 |
|
|
324042 |
126676812 |
1 |
NF2C12H15 |
AB2C12D15 |
-86.74 |
1.82 |
-9.25 |
-0.22 |
0 |
|
|
324043 |
126676813 |
1 |
NC14H21 |
AB14C21 |
-1.7 |
1.9 |
-8.54 |
0.55 |
0 |
|
|
324044 |
126676816 |
1 |
NF3C13H16 |
AB3C13D16 |
-157.18 |
2.61 |
-9.37 |
-0.48 |
0 |
|
|
324045 |
126676820 |
1 |
NF2C13H17 |
AB2C13D17 |
-100.58 |
3.6 |
-9.31 |
0.26 |
0 |
|
|
324046 |
126676825 |
1 |
OC10H14 |
AB10C14 |
-8.95 |
3.36 |
-9.84 |
-0.13 |
0 |
|
|
324047 |
126676827 |
1 |
NC18H21 |
AB18C21 |
31.04 |
2.39 |
-9.1 |
0.33 |
0 |
|
|
324048 |
126676831 |
2 |
N2O2C11H14 |
A2B2C11D14 |
-108.97 |
3.37 |
-9.0 |
-1.08 |
0 |
|
|
324049 |
126676833 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-32.1 |
5.57 |
-8.33 |
-0.85 |
0 |
|
|
324050 |
126676834 |
1 |
O3N5C19H21 |
A3B5C19D21 |
-48.06 |
2.27 |
-9.0 |
-1.18 |
0 |
|
|
324051 |
126676835 |
1 |
N3O4C20H23 |
A3B4C20D23 |
-134.01 |
2.12 |
-9.61 |
-1.16 |
0 |
|
|
324052 |
126676837 |
1 |
O2N3C23H29 |
A2B3C23D29 |
-35.8 |
6.88 |
-8.41 |
-0.67 |
0 |
|
|
324053 |
126676838 |
1 |
N3O3C20H23 |
A3B3C20D23 |
-85.59 |
3.42 |
-9.47 |
-0.99 |
0 |
|
|
324054 |
126676842 |
1 |
N7H11C17 |
A7B11C17 |
193.64 |
6.4 |
-9.31 |
-1.71 |
0 |
|
|
324055 |
126676845 |
1 |
SN7H13C18 |
AB7C13D18 |
192.07 |
5.05 |
-8.93 |
-1.77 |
0 |
|
|
324056 |
126676848 |
1 |
N7H15C20 |
A7B15C20 |
172.27 |
2.83 |
-9.08 |
-1.34 |
0 |
|
|
324057 |
126676849 |
1 |
O2N3C8H13 |
A2B3C8D13 |
-27.05 |
4.16 |
-9.83 |
-0.51 |
0 |
|
|
324058 |
126676850 |
1 |
N3O3C20H23 |
A3B3C20D23 |
-82.35 |
3.5 |
-9.45 |
-1.02 |
0 |
|
|
324059 |
126676851 |
1 |
FN3O4C21H24 |
AB3C4D21E24 |
-166.63 |
3.55 |
-9.35 |
-1.16 |
0 |
|
|
324060 |
126676854 |
1 |
FO3N4C23H27 |
AB3C4D23E27 |
-137.46 |
4.9 |
-9.45 |
-1.12 |
0 |
|
|
324061 |
126676856 |
1 |
O3N5H25C27 |
A3B5C25D27 |
88.07 |
6.3 |
-8.9 |
-1.61 |
0 |
|
|
324062 |
126676862 |
6 |
NH2C3 |
AB2C3 |
182.92 |
3.25 |
-8.84 |
-1.51 |
0 |
|
|
324063 |
126676863 |
1 |
N3O5C17H19 |
A3B5C17D19 |
-173.79 |
2.94 |
-9.31 |
-1.19 |
0 |
|
|
324064 |
126676864 |
1 |
N7H15C19 |
A7B15C19 |
171.61 |
2.17 |
-8.49 |
-0.88 |
0 |
|
|
324065 |
126676867 |
1 |
N7H17C19 |
A7B17C19 |
156.12 |
3.47 |
-8.31 |
-0.75 |
0 |
|
|
324066 |
126676868 |
1 |
FN3O4C20H22 |
AB3C4D20E22 |
-158.21 |
2.81 |
-9.39 |
-1.23 |
0 |
|
|
324067 |
126676869 |
1 |
ON6C21H28 |
AB6C21D28 |
28.7 |
4.2 |
-7.91 |
-0.4 |
0 |
|
|
324068 |
126676871 |
1 |
FON2C9H9 |
ABC2D9E9 |
-53.29 |
0.79 |
-8.34 |
-0.34 |
0 |
|
|
324069 |
126676873 |
1 |
N7H15C20 |
A7B15C20 |
171.19 |
1.43 |
-8.83 |
-1.23 |
0 |
|
|
324070 |
126676874 |
1 |
F2N7H13C20 |
A2B7C13D20 |
76.81 |
4.41 |
-9.01 |
-1.4 |
0 |
|
|
324071 |
126676875 |
1 |
S3N4C16H16 |
A3B4C16D16 |
110.23 |
2.39 |
-8.33 |
-0.96 |
0 |
|
|
324072 |
126676877 |
1 |
O2N3C8H13 |
A2B3C8D13 |
-27.0 |
4.07 |
-9.84 |
-0.52 |
0 |
|
|
324073 |
126676880 |
1 |
ON2C11H18 |
AB2C11D18 |
-9.69 |
4.56 |
-8.83 |
0.17 |
0 |
|
|
324074 |
126676881 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-33.99 |
5.81 |
-8.26 |
-0.43 |
0 |
|
|
324075 |
126676882 |
1 |
N7H21C27 |
A7B21C27 |
154.83 |
3.3 |
-8.27 |
-1.01 |
0 |
|
|
324076 |
126676884 |
2 |
N4H10C11 |
A4B10C11 |
142.44 |
1.1 |
-8.39 |
-0.84 |
0 |
|
|
324077 |
126676885 |
2 |
N4H13C14 |
A4B13C14 |
140.03 |
2.56 |
-8.0 |
-0.89 |
0 |
|
|
324078 |
126676886 |
1 |
N3O3C25H25 |
A3B3C25D25 |
-59.58 |
4.0 |
-9.28 |
-1.13 |
0 |
|
|
324079 |
126676888 |
1 |
ON4C8H16 |
AB4C8D16 |
-3.07 |
2.56 |
-8.45 |
0.32 |
0 |
|
|
324080 |
126676889 |
1 |
ON2C13H22 |
AB2C13D22 |
-23.44 |
4.46 |
-8.44 |
-0.05 |
0 |
|
|
324081 |
126676892 |
1 |
O2F3N4C21H23 |
A2B3C4D21E23 |
-125.69 |
4.54 |
-8.6 |
-0.99 |
0 |
|
|
324082 |
126676893 |
1 |
BrNSC9H12 |
ABCD9E12 |
20.11 |
2.04 |
-9.19 |
-0.54 |
0 |
|
|
324083 |
126676895 |
1 |
ON7C16H21 |
AB7C16D21 |
61.6 |
1.94 |
-8.18 |
-0.28 |
0 |
|
|
324084 |
126676897 |
2 |
N2O6C11H21 |
A2B6C11D21 |
-558.7 |
7.64 |
-9.55 |
0.51 |
0 |
|
|
324085 |
126676898 |
1 |
O3N4C18H18 |
A3B4C18D18 |
24.69 |
1.35 |
-9.63 |
-0.98 |
0 |
|
|
324086 |
126676899 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-15.02 |
6.47 |
-9.71 |
-1.07 |
0 |
|
|
324087 |
126676900 |
1 |
F3O3N4H15C16 |
A3B3C4D15E16 |
-198.78 |
6.36 |
-9.19 |
-0.82 |
0 |
|
|
324088 |
126676904 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-94.07 |
3.55 |
-8.74 |
-0.96 |
0 |
|
|
324089 |
126676905 |
1 |
OF3N3H10C11 |
AB3C3D10E11 |
-135.12 |
0.34 |
-9.43 |
-1.12 |
0 |
|
|
324090 |
126676906 |
1 |
O3N4H14C16 |
A3B4C14D16 |
-45.13 |
3.64 |
-9.36 |
-1.2 |
0 |
|
|
324091 |
126676908 |
3 |
NOC5H5 |
ABC5D5 |
-73.76 |
5.2 |
-9.57 |
-1.06 |
0 |
|
|
324092 |
126676909 |
1 |
NOC10H17 |
ABC10D17 |
-54.67 |
1.51 |
-7.93 |
1.51 |
0 |
|
|
324093 |
126676910 |
1 |
NSF3O7C14H20 |
ABC3D7E14F20 |
-459.8 |
3.95 |
-9.75 |
-1.93 |
0 |