List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
4772 |
12002 |
3 |
BrHC2 |
ABC2 |
33.24 |
1.18 |
-9.83 |
-0.92 |
0 |
|
|
4773 |
12003 |
1 |
OBr2H4C6 |
AB2C4D6 |
-14.7 |
1.92 |
-9.41 |
-0.65 |
0 |
|
|
4774 |
12004 |
1 |
NBr2H5C6 |
AB2C5D6 |
21.95 |
3.19 |
-8.76 |
-0.35 |
0 |
|
|
4775 |
12010 |
2 |
OSC3H5 |
ABC3D5 |
-54.08 |
4.82 |
-9.02 |
-1.39 |
0 |
|
|
4776 |
12014 |
6 |
CH2 |
AB2 |
-16.12 |
0.44 |
-9.11 |
1.6 |
0 |
|
|
4777 |
12015 |
1 |
ClC5H11 |
AB5C11 |
-38.92 |
2.1 |
-10.45 |
1.06 |
0 |
|
|
4778 |
12017 |
2 |
ClC2H4 |
AB2C4 |
-44.04 |
0.74 |
-10.83 |
0.04 |
0 |
|
|
4779 |
12018 |
1 |
OCl2C3H6 |
AB2C3D6 |
-78.47 |
1.43 |
-10.87 |
-0.2 |
0 |
|
|
4780 |
12019 |
1 |
NC5H13 |
AB5C13 |
-26.42 |
1.86 |
-9.23 |
3.64 |
0 |
|
|
4781 |
12020 |
1 |
OC5H10 |
AB5C10 |
-46.66 |
1.97 |
-10.4 |
0.9 |
0 |
|
|
4782 |
12021 |
3 |
COH2 |
ABC2 |
-128.91 |
0.16 |
-11.41 |
0.04 |
0 |
|
|
4783 |
12022 |
1 |
NC5H13 |
AB5C13 |
-13.84 |
1.39 |
-8.55 |
2.92 |
0 |
|
|
4784 |
12023 |
1 |
NC5H7 |
AB5C7 |
16.51 |
1.62 |
-8.65 |
1.24 |
0 |
|
|
4785 |
12024 |
1 |
SC5H6 |
AB5C6 |
20.5 |
1.25 |
-8.78 |
0.02 |
0 |
|
|
4786 |
12027 |
2 |
O2C3H5 |
A2B3C5 |
-195.42 |
4.79 |
-11.26 |
-0.43 |
0 |
|
|
4787 |
12029 |
2 |
NO2C4H4 |
AB2C4D4 |
-5.81 |
6.49 |
-10.99 |
-1.75 |
0 |
|
|
4788 |
12030 |
1 |
N2O5H6C7 |
A2B5C6D7 |
-37.81 |
7.41 |
-10.8 |
-1.75 |
0 |
|
|
4789 |
12031 |
2 |
O2C5H5 |
A2B5C5 |
-153.78 |
5.59 |
-10.28 |
-0.57 |
0 |
|
|
4790 |
12034 |
2 |
O2C4H7 |
A2B4C7 |
-203.51 |
3.6 |
-11.2 |
-0.4 |
0 |
|
|
4791 |
12045 |
1 |
O4C7H10 |
A4B7C10 |
-163.29 |
1.4 |
-10.95 |
-1.0 |
0 |
|
|
4792 |
12046 |
2 |
O2C3H5 |
A2B3C5 |
-194.32 |
6.02 |
-10.83 |
-0.14 |
0 |
|
|
4793 |
12047 |
1 |
ClN2O2C6H15 |
AB2C2D6E15 |
-136.49 |
5.52 |
-9.94 |
0.37 |
0 |
|
|
4794 |
12048 |
1 |
C7H16 |
A7B16 |
-39.11 |
0.05 |
-10.84 |
4.19 |
0 |
|
|
4795 |
12049 |
1 |
NC6H15 |
AB6C15 |
-29.96 |
2.07 |
-9.26 |
3.7 |
0 |
|
|
4796 |
12050 |
1 |
N2C5H10 |
A2B5C10 |
19.03 |
4.69 |
-9.65 |
1.25 |
0 |
|
|
4797 |
12052 |
1 |
SiC6H16 |
AB6C16 |
-46.68 |
0.38 |
-9.59 |
1.29 |
0 |
|
|
4798 |
12054 |
1 |
PO5C7H7 |
AB5C7D7 |
-239.68 |
3.63 |
-10.65 |
-1.26 |
0 |
|
|
4799 |
12055 |
1 |
AsN2O4C8H11 |
AB2C4D8E11 |
-122.09 |
1.01 |
-9.04 |
-0.29 |
0 |
|
|
4800 |
12057 |
1 |
SO2C6H6 |
AB2C6D6 |
-46.35 |
3.76 |
-9.05 |
-0.5 |
0 |
|
|
4801 |
12058 |
1 |
NOC7H13 |
ABC7D13 |
-65.2 |
4.3 |
-9.3 |
1.16 |
0 |
|
|
4802 |
12059 |
1 |
OC9H12 |
AB9C12 |
-40.94 |
2.03 |
-8.94 |
0.27 |
0 |
|
|
4803 |
12062 |
1 |
N2O2C7H8 |
A2B2C7D8 |
-65.85 |
6.56 |
-8.79 |
-0.42 |
0 |
|
|
4804 |
12065 |
1 |
I2O3H4C7 |
A2B3C4D7 |
-69.2 |
4.57 |
-9.85 |
-1.8 |
0 |
|
|
4805 |
12066 |
1 |
NCl2H3O3C6 |
AB2C3D3E6 |
-40.18 |
4.47 |
-10.09 |
-1.79 |
0 |
|
|
4806 |
12068 |
1 |
N3O4H5C6 |
A3B4C5D6 |
15.78 |
6.48 |
-9.82 |
-2.11 |
0 |
|
|
4807 |
12069 |
1 |
NH5O6C8 |
AB5C6D8 |
-138.95 |
1.1 |
-11.8 |
-2.43 |
0 |
|
|
4808 |
12070 |
1 |
BrO2H7C8 |
AB2C7D8 |
-57.95 |
0.59 |
-9.96 |
-0.97 |
0 |
|
|
4809 |
12072 |
1 |
OC10H18 |
AB10C18 |
-65.49 |
2.77 |
-9.38 |
1.63 |
0 |
|
|
4810 |
12073 |
1 |
O2C9H10 |
A2B9C10 |
-77.83 |
6.61 |
-9.77 |
-0.56 |
0 |
|
|
4811 |
12077 |
1 |
O3H6C8 |
A3B6C8 |
-84.47 |
5.67 |
-10.72 |
-1.39 |
0 |
|
|
4812 |
12079 |
1 |
N2O2H4C7 |
A2B2C4D7 |
52.74 |
4.47 |
-11.03 |
-1.89 |
0 |
|
|
4813 |
12080 |
2 |
ClOC3H6 |
ABC3D6 |
-122.55 |
3.05 |
-10.39 |
0.16 |
0 |
|
|
4814 |
12082 |
1 |
NO2C8H9 |
AB2C8D9 |
-65.97 |
4.22 |
-8.9 |
-0.3 |
0 |
|
|
4815 |
12084 |
1 |
ClNOH6C7 |
ABCD6E7 |
-28.32 |
3.54 |
-9.93 |
-0.73 |
0 |
|
|
4816 |
12086 |
1 |
O2C9H10 |
A2B9C10 |
-73.24 |
6.15 |
-10.09 |
-0.67 |
0 |
|
|
4817 |
12089 |
1 |
N2O2C7H8 |
A2B2C7D8 |
-41.85 |
5.25 |
-9.25 |
-0.73 |
0 |
|
|
4818 |
12090 |
1 |
N2O2H4C7 |
A2B2C4D7 |
52.75 |
1.37 |
-11.14 |
-2.06 |
0 |
|
|
4819 |
12091 |
1 |
N2O3H6C7 |
A2B3C6D7 |
-21.88 |
4.82 |
-10.91 |
-1.79 |
0 |
|
|
4820 |
12092 |
1 |
NO2C9H11 |
AB2C9D11 |
-61.35 |
7.94 |
-8.73 |
-0.38 |
0 |
|
|
4821 |
12094 |
1 |
NO4C9H9 |
AB4C9D9 |
-77.26 |
6.15 |
-10.61 |
-1.48 |
0 |