List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
3748 |
10107 |
1 |
PCl3O4C12H14 |
AB3C4D12E14 |
-241.81 |
1.92 |
-9.63 |
-0.82 |
0 |
|
|
3749 |
10108 |
1 |
OC9H14 |
AB9C14 |
-59.65 |
3.4 |
-9.66 |
0.75 |
0 |
|
|
3750 |
10110 |
1 |
H2O2C3 |
A2B2C3 |
-23.23 |
4.97 |
-11.55 |
-0.54 |
0 |
|
|
3751 |
10111 |
1 |
C2N3H7 |
A2B3C7 |
13.62 |
2.07 |
-9.36 |
1.2 |
0 |
|
|
3752 |
10112 |
1 |
CCaO3 |
ABC3 |
-140.52 |
12.32 |
-9.71 |
-1.99 |
0 |
|
|
3753 |
10113 |
2 |
CNOH2 |
ABCD2 |
-82.45 |
0.01 |
-10.45 |
-0.36 |
0 |
|
|
3754 |
10114 |
2 |
O2C15H23 |
A2B15C23 |
-242.73 |
4.1 |
-9.59 |
-0.01 |
0 |
|
|
3755 |
10115 |
2 |
C15H26 |
A15B26 |
-96.31 |
0.25 |
-9.51 |
3.7 |
0 |
|
|
3756 |
10116 |
2 |
OC10H15 |
AB10C15 |
-111.6 |
5.2 |
-9.44 |
0.76 |
0 |
|
|
3757 |
10117 |
2 |
OC10H15 |
AB10C15 |
-122.09 |
5.0 |
-8.28 |
0.73 |
0 |
|
|
3758 |
10121 |
8 |
C5H7 |
A5B7 |
48.02 |
1.44 |
-7.9 |
0.03 |
0 |
|
|
3759 |
10123 |
3 |
C5H8 |
A5B8 |
-23.36 |
0.73 |
-9.01 |
1.4 |
0 |
|
|
3760 |
10129 |
2 |
C5H9 |
A5B9 |
-18.62 |
0.28 |
-10.01 |
3.79 |
0 |
|
|
3761 |
10130 |
1 |
O3C10H16 |
A3B10C16 |
-148.92 |
5.25 |
-10.13 |
0.55 |
0 |
|
|
3762 |
10132 |
1 |
H2C3O5 |
A2B3C5 |
-173.84 |
4.32 |
-11.04 |
-2.56 |
0 |
|
|
3763 |
10133 |
4 |
OC6H10 |
AB6C10 |
-248.14 |
5.41 |
-10.06 |
0.62 |
0 |
|
|
3764 |
10136 |
1 |
NO7C33H49 |
AB7C33D49 |
-335.5 |
6.06 |
-8.59 |
0.84 |
0 |
|
|
3765 |
10137 |
3 |
C5H8 |
A5B8 |
26.06 |
0.94 |
-9.6 |
1.52 |
0 |
|
|
3766 |
10139 |
1 |
F2Cl3H9C14 |
A2B3C9D14 |
-73.42 |
1.33 |
-9.82 |
-0.68 |
0 |
|
|
3767 |
10141 |
2 |
O2H3C5 |
A2B3C5 |
-107.4 |
2.32 |
-9.19 |
-2.01 |
0 |
|
|
3768 |
10143 |
1 |
NO4C20H23 |
AB4C20D23 |
-111.05 |
5.3 |
-8.07 |
-0.31 |
0 |
|
|
3769 |
10145 |
1 |
NO4C21H25 |
AB4C21D25 |
-108.24 |
2.78 |
-7.94 |
-0.2 |
0 |
|
|
3770 |
10147 |
1 |
NO5H19C20 |
AB5C19D20 |
-133.51 |
1.67 |
-8.63 |
-0.2 |
0 |
|
|
3771 |
10150 |
1 |
O6H10C15 |
A6B10C15 |
-205.83 |
2.7 |
-9.04 |
-1.9 |
0 |
|
|
3772 |
10153 |
1 |
NO4C20H23 |
AB4C20D23 |
-107.25 |
0.18 |
-8.02 |
-0.11 |
0 |
|
|
3773 |
10154 |
1 |
NO4C19H21 |
AB4C19D21 |
-116.58 |
2.79 |
-8.03 |
-0.32 |
0 |
|
|
3774 |
10156 |
1 |
NO6C21H23 |
AB6C21D23 |
-177.63 |
8.27 |
-8.78 |
-0.45 |
0 |
|
|
3775 |
10157 |
1 |
O7C21H24 |
A7B21C24 |
-291.65 |
5.88 |
-9.25 |
-1.1 |
0 |
|
|
3776 |
10165 |
1 |
NO5C21H25 |
AB5C21D25 |
-154.9 |
2.37 |
-8.19 |
0.26 |
0 |
|
|
3777 |
10166 |
4 |
OC4H4 |
AB4C4 |
-120.08 |
3.75 |
-9.42 |
-1.65 |
0 |
|
|
3778 |
10167 |
1 |
O5H10C13 |
A5B10C13 |
-130.07 |
4.74 |
-8.37 |
-0.69 |
0 |
|
|
3779 |
10168 |
1 |
O6H8C15 |
A6B8C15 |
-180.47 |
2.89 |
-9.74 |
-2.31 |
0 |
|
|
3780 |
10169 |
1 |
O7H8C15 |
A7B8C15 |
-228.75 |
4.67 |
-9.87 |
-2.24 |
0 |
|
|
3781 |
10172 |
1 |
NO2C15H15 |
AB2C15D15 |
-50.02 |
7.19 |
-8.29 |
-0.22 |
0 |
|
|
3782 |
10174 |
1 |
O5H8C15 |
A5B8C15 |
-109.84 |
6.87 |
-8.75 |
-1.59 |
0 |
|
|
3783 |
10175 |
2 |
O2H6C7 |
A2B6C7 |
-124.35 |
4.08 |
-9.51 |
-0.57 |
0 |
|
|
3784 |
10183 |
2 |
O4H6C7 |
A4B6C7 |
-303.85 |
5.52 |
-9.19 |
-1.74 |
0 |
|
|
3785 |
10196 |
1 |
NO5C18H23 |
AB5C18D23 |
-177.78 |
5.46 |
-8.95 |
0.23 |
0 |
|
|
3786 |
10197 |
1 |
NO5C15H25 |
AB5C15D25 |
-235.1 |
3.87 |
-9.25 |
0.09 |
0 |
|
|
3787 |
10198 |
1 |
NO2C8H13 |
AB2C8D13 |
-77.59 |
1.98 |
-9.05 |
0.66 |
0 |
|
|
3788 |
10200 |
1 |
NSH7C8 |
ABC7D8 |
42.0 |
2.41 |
-8.1 |
-0.2 |
0 |
|
|
3789 |
10202 |
3 |
C9H16 |
A9B16 |
-95.85 |
0.17 |
-9.88 |
3.77 |
0 |
|
|
3790 |
10203 |
1 |
O2C19H30 |
A2B19C30 |
-142.76 |
2.35 |
-9.7 |
0.74 |
0 |
|
|
3791 |
10205 |
1 |
O3H8C11 |
A3B8C11 |
-70.17 |
2.52 |
-9.63 |
-1.7 |
0 |
|
|
3792 |
10207 |
5 |
OH2C3 |
AB2C3 |
-150.23 |
2.23 |
-9.45 |
-1.86 |
0 |
|
|
3793 |
10210 |
2 |
O2H5C7 |
A2B5C7 |
-124.44 |
4.54 |
-10.0 |
-0.78 |
0 |
|
|
3794 |
10212 |
2 |
O2H7C8 |
A2B7C8 |
-86.64 |
5.93 |
-8.57 |
-1.16 |
0 |
|
|
3795 |
10214 |
1 |
SP2N5C10O13H15 |
AB2C5D10E13F15 |
-622.93 |
8.97 |
-9.55 |
-1.61 |
0 |
|
|
3796 |
10218 |
2 |
NO2C14H19 |
AB2C14D19 |
-142.3 |
4.8 |
-8.4 |
0.06 |
0 |
|
|
3797 |
10219 |
1 |
N2O4C29H40 |
A2B4C29D40 |
-132.17 |
1.86 |
-7.88 |
0.08 |
0 |
|
|
3798 |
10221 |
1 |
O3H8C11 |
A3B8C11 |
-67.68 |
5.6 |
-9.64 |
-1.71 |
0 |
|
|
3799 |
10222 |
18 |
CH |
AB |
26.33 |
0.76 |
-8.54 |
-0.37 |
0 |
|
|
3800 |
10224 |
1 |
C15H22 |
A15B22 |
-23.8 |
0.54 |
-8.72 |
0.65 |
0 |
|
|
3801 |
10226 |
1 |
SN2H6O8C10 |
AB2C6D8E10 |
-128.75 |
4.18 |
-10.64 |
-2.56 |
0 |
|
|
3802 |
10227 |
1 |
NO4H13C14 |
AB4C13D14 |
-78.09 |
4.28 |
-8.44 |
-0.74 |
0 |
|
|
3803 |
10231 |
2 |
O2C6H7 |
A2B6C7 |
-103.46 |
2.81 |
-8.3 |
-0.06 |
0 |
|
|
3804 |
10232 |
1 |
N2H16C21 |
A2B16C21 |
104.15 |
3.41 |
-8.43 |
-0.54 |
0 |
|
|
3805 |
10233 |
1 |
NO4C19H23 |
AB4C19D23 |
-122.56 |
4.89 |
-8.22 |
0.16 |
0 |
|
|
3806 |
10234 |
1 |
N2O6C15H18 |
A2B6C15D18 |
-87.5 |
9.1 |
-10.34 |
-1.8 |
0 |
|
|
3807 |
10237 |
1 |
NO6H17C20 |
AB6C17D20 |
-152.88 |
5.27 |
-8.67 |
-0.95 |
0 |
|
|
3808 |
10238 |
1 |
PSN5C10O10H14 |
ABC5D10E10F14 |
-423.14 |
2.23 |
-9.2 |
-1.77 |
0 |
|
|
3809 |
10239 |
1 |
NO3H11C16 |
AB3C11D16 |
-49.07 |
5.41 |
-9.57 |
-1.51 |
0 |
|
|
3810 |
10240 |
1 |
NS2C21H29 |
AB2C21D29 |
26.57 |
1.05 |
-8.54 |
-0.28 |
0 |
|
|
3811 |
10242 |
1 |
N2O2H10C11 |
A2B2C10D11 |
-46.74 |
0.68 |
-9.33 |
-0.88 |
0 |
|
|
3812 |
10243 |
1 |
NO2H7C10 |
AB2C7D10 |
-29.57 |
3.43 |
-9.95 |
-1.48 |
0 |
|
|
3813 |
10246 |
1 |
ON2C15H20 |
AB2C15D20 |
-39.22 |
6.6 |
-8.57 |
0.13 |
0 |
|
|
3814 |
10250 |
2 |
OH2N2C3 |
AB2C2D3 |
-31.49 |
3.87 |
-10.28 |
-1.77 |
0 |
|
|
3815 |
10252 |
1 |
NO3C9H9 |
AB3C9D9 |
-113.8 |
5.13 |
-9.88 |
-0.92 |
0 |
|
|
3816 |
10253 |
1 |
NO4C9H9 |
AB4C9D9 |
-150.36 |
7.8 |
-9.96 |
-1.0 |
0 |
|
|
3817 |
10254 |
1 |
OC10H12 |
AB10C12 |
-34.08 |
3.66 |
-9.45 |
-0.34 |
0 |
|
|
3818 |
10257 |
1 |
ON2C12H16 |
AB2C12D16 |
-10.44 |
3.55 |
-8.21 |
-0.1 |
0 |
|
|
3819 |
10259 |
1 |
NO4C16H27 |
AB4C16D27 |
-183.13 |
3.65 |
-8.72 |
0.46 |
0 |
|
|
3820 |
10260 |
1 |
N2O2S2H6C7 |
A2B2C2D6E7 |
-33.05 |
7.31 |
-9.24 |
-2.1 |
0 |
|
|
3821 |
10263 |
2 |
C5H7 |
A5B7 |
-9.24 |
0.89 |
-8.66 |
0.72 |
0 |
|
|
3822 |
10264 |
1 |
C5O6H10 |
A5B6C10 |
-272.5 |
4.24 |
-11.06 |
0.16 |
0 |
|
|
3823 |
10265 |
1 |
NOCl5C27H46 |
ABC5D27E46 |
-141.07 |
16.31 |
-7.68 |
-0.31 |
0 |
|
|
3824 |
10266 |
1 |
NO5C6H15 |
AB5C6D15 |
-238.68 |
3.8 |
-10.06 |
1.55 |
0 |
|
|
3825 |
10267 |
2 |
PC3O6H7 |
AB3C6D7 |
-675.13 |
3.53 |
-11.28 |
-0.1 |
0 |
|
|
3826 |
10268 |
1 |
O3H4C5 |
A3B4C5 |
-91.21 |
5.02 |
-10.42 |
-0.65 |
0 |
|
|
3827 |
10269 |
1 |
O2C15H24 |
A2B15C24 |
-105.8 |
2.99 |
-8.11 |
0.31 |
0 |
|
|
3828 |
10270 |
3 |
C5H8 |
A5B8 |
6.47 |
0.96 |
-9.41 |
1.46 |
0 |
|
|
3829 |
10271 |
2 |
H2N2C3O3 |
A2B2C3D3 |
3.45 |
3.42 |
-10.82 |
-2.51 |
0 |
|
|
3830 |
10272 |
2 |
NOC6H10 |
ABC6D10 |
-60.56 |
2.51 |
-8.96 |
-0.64 |
0 |
|
|
3831 |
10273 |
1 |
NO4H5C7 |
AB4C5D7 |
-131.27 |
3.35 |
-11.11 |
-1.76 |
0 |
|
|
3832 |
10274 |
1 |
O7H10C15 |
A7B10C15 |
-203.08 |
4.4 |
-8.84 |
-1.94 |
0 |
|
|
3833 |
10275 |
1 |
SN3C9H9 |
AB3C9D9 |
54.21 |
1.14 |
-8.19 |
-0.33 |
0 |
|
|
3834 |
10276 |
1 |
O5C10H12 |
A5B10C12 |
-178.61 |
6.48 |
-8.82 |
-0.69 |
0 |
|
|
3835 |
10279 |
1 |
O3C8H8 |
A3B8C8 |
-110.33 |
3.03 |
-8.83 |
-1.02 |
0 |
|
|
3836 |
10280 |
6 |
CHO |
ABC |
-204.25 |
4.28 |
-10.07 |
-1.99 |
0 |
|
|
3837 |
10282 |
1 |
OC10H18 |
AB10C18 |
-72.86 |
3.04 |
-9.61 |
1.09 |
0 |
|
|
3838 |
10286 |
1 |
O2H6C9 |
A2B6C9 |
-33.06 |
3.63 |
-9.65 |
-0.82 |
0 |
|
|
3839 |
10287 |
2 |
O3H6C8 |
A3B6C8 |
-174.31 |
3.98 |
-8.56 |
-1.05 |
0 |
|
|
3840 |
10288 |
3 |
OH4C5 |
AB4C5 |
-91.76 |
2.88 |
-8.07 |
-0.88 |
0 |
|
|
3841 |
10289 |
2 |
O3H6C8 |
A3B6C8 |
-170.36 |
10.37 |
-8.99 |
-1.74 |
0 |
|
|
3842 |
10290 |
1 |
ON3C19H29 |
AB3C19D29 |
-27.28 |
1.36 |
-8.02 |
-0.33 |
0 |
|
|
3843 |
10291 |
1 |
O3H5N5C6 |
A3B5C5D6 |
-67.85 |
9.24 |
-9.26 |
-1.15 |
0 |
|
|
3844 |
10292 |
2 |
NC6H6 |
AB6C6 |
41.98 |
1.8 |
-8.22 |
0.25 |
0 |
|
|
3845 |
10294 |
1 |
HgNO5C13H16 |
ABC5D13E16 |
-120.42 |
2.55 |
0.0 |
0.0 |
0 |
|
|
3846 |
10295 |
1 |
OSH8C13 |
ABC8D13 |
19.02 |
2.36 |
-8.74 |
-1.05 |
0 |
|
|
3847 |
10298 |
1 |
N3C17H21 |
A3B17C21 |
68.98 |
4.65 |
-8.07 |
0.19 |
0 |